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Mrv2104 02212314012D

11 11  0  0  0  0            999 V2000
    0.4241    0.7803    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2903    0.3678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2903   -0.4572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4241   -0.8696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1386   -0.4572    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1386    0.3678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4241    1.6053    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2903    2.0178    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4241   -1.6946    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2903   -2.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1385   -2.1071    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  0  0  0  0
  5  6  1  0  0  0  0
  1  7  1  0  0  0  0
  4  9  1  0  0  0  0
  9 11  1  0  0  0  0
  7  8  1  0  0  0  0
  9 10  2  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 — 7 of approximately 7 results

PHUB001023 Score: 1.0	Dihydroperillyl alcohol 22521-57-9 metabolite	C₁₀H₁₈O Mono mass: 154.1357652
PHUB002629 Score: 1.0	p-mentha-8-en-7-ol metabolite	C₁₀H₁₈O Mono mass: 154.1357652
PHUB000972 Score: 0.789	Dihydrocarveol metabolite	C₁₀H₁₈O Mono mass: 154.1357652
PHUB001811 Score: 0.789	Isopulegol 89-79-2 metabolite	C₁₀H₁₈O Mono mass: 154.1357652
PHUB000053 Score: 0.722	Linalool (8-hydroxydihydro-) precursor	C₁₀H₂₀O₂ Mono mass: 172.146329884
PHUB000990 Score: 0.714	Limonene-1,2-diol metabolite	C₁₀H₁₈O₂ Mono mass: 170.13067982
PHUB001000 Score: 0.714	Dihydroperillic acid (trans-) metabolite	C₁₀H₁₆O₂ Mono mass: 168.115029755
PHUB001001 Score: 0.714	Dihydroperillic acid (cis-) metabolite	C₁₀H₁₆O₂ Mono mass: 168.115029755
PHUB001847 Score: 0.714	Limonene-1,2-glycol	C₁₀H₁₈O₂ Mono mass: 170.13067982