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Mrv2104 06072104282D

12 12  0  0  0  0            999 V2000
    0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  2  8  1  0  0  0  0
  3  4  1  0  0  0  0
  3  7  1  0  0  0  0
  4  9  1  0  0  0  0
  5  7  1  0  0  0  0
  5 10  1  0  0  0  0
  6  8  1  0  0  0  0
  6 11  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
 10 12  1  0  0  0  0
M  END

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(+)-Catechin
  Mrv1572001071604202D

21 23  0  0  1  0            999 V2000
    2.0414   -2.6714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3269   -2.2589    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.6125   -2.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1020   -2.2589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -2.6714    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -3.4964    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5310   -2.2589    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5310   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2454   -1.0214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8165   -1.0214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1020   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6125   -1.0214    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3269   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0414   -1.0214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0414   -0.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7559    0.2161    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4703   -0.1964    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1848    0.2161    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4703   -1.0214    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7559   -1.4339    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1848   -1.4339    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  1  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  5  6  1  0  0  0  0
  5  7  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
  4 11  2  0  0  0  0
 11 12  1  0  0  0  0
 12 13  1  0  0  0  0
  2 13  1  0  0  0  0
 15 16  2  0  0  0  0
 17 18  1  0  0  0  0
 17 19  2  0  0  0  0
 14 20  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  1  0  0  0  0
 16 17  1  0  0  0  0
 19 20  1  0  0  0  0
 19 21  1  0  0  0  0
 10 11  1  0  0  0  0
  8  7  1  0  0  0  0
  4  5  1  0  0  0  0
M  END

Results 1 — 17 of approximately 17 results

PHUB001011 Score: 1.0	7-hydroxymenthol metabolite	C₁₀H₂₀O₂ Mono mass: 172.146329884
PHUB001019 Score: 1.0	9-hydroxymenthol metabolite	C₁₀H₂₀O₂ Mono mass: 172.146329884
PHUB001014 Score: 0.933	p-menthane-3,7,8-triol metabolite	C₁₀H₂₀O₃ Mono mass: 188.141244504
PHUB000062 Score: 0.929	(-)-Menthol 2216-51-5 precursor	C₁₀H₂₀O Mono mass: 156.151415264
PHUB002809 Score: 0.929	(+)-Neomenthol 491-01-0 precursor	C₁₀H₂₀O Mono mass: 156.151415264
PHUB002811 Score: 0.929	Isomenthol 3623-52-7 precursor	C₁₀H₂₀O Mono mass: 156.151415264
PHUB001015 Score: 0.867	8-Hydroxymenthol metabolite	C₁₀H₂₀O₂ Mono mass: 172.146329884
PHUB001780 Score: 0.839	(+)-Borneol 464-43-7 precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB001786 Score: 0.839	Isoborneol metabolite	C₁₀H₁₈O Mono mass: 154.1357652
PHUB002859 Score: 0.839	(-)-borneol 464-45-9 precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB000084 Score: 0.788	4-thujanol (cis) precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB000085 Score: 0.788	4-thujanol (trans) precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB000093 Score: 0.788	Thujan-3-ol precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB000957 Score: 0.788	Camphene-2,10-glycol metabolite	C₁₀H₁₈O₂ Mono mass: 170.13067982
PHUB000958 Score: 0.788	Camphene-10,2-glycol metabolite	C₁₀H₁₈O₂ Mono mass: 170.13067982
PHUB000961 Score: 0.788	3-Hydroxytricyclene metabolite	C₁₀H₁₆O Mono mass: 152.120115135
PHUB001822 Score: 0.786	tetrahydrolinalool 78-69-3 metabolite	C₁₀H₂₂O Mono mass: 158.167065328
PHUB001797 Score: 0.75	1,4-cineole precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB003070 Score: 0.71	Myrtanol 514-99-8 metabolite	C₁₀H₁₈O Mono mass: 154.1357652