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Mrv2104 03172315192D

11 11  0  0  0  0            999 V2000
   -2.0759    0.3093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0759   -0.5156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3614   -0.9282    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.6470   -0.5156    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6469    0.3093    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3614    0.7218    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.3614    1.5468    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7904    0.7218    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3613   -1.7531    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0759    1.9593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6470    1.9593    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
  6  7  1  6  0  0  0
  3  9  1  1  0  0  0
  7 10  1  0  0  0  0
  7 11  1  0  0  0  0
  1  8  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 — 6 of approximately 6 results

PHUB000063 Score: 1.0	(-)-Menthone 89-80-5 / 14073-97-3 precursor	C₁₀H₁₈O Mono mass: 154.1357652
PHUB000028 Score: 0.893	Camphor precursor	C₁₀H₁₆O Mono mass: 152.120115135
PHUB001813 Score: 0.893	(+)-fenchone precursor	C₁₀H₁₆O Mono mass: 152.120115135
PHUB000095 Score: 0.833	Thujone precursor	C₁₀H₁₆O Mono mass: 152.120115135
PHUB001784 Score: 0.806	2,5-Bornanedione metabolite	C₁₀H₁₄O₂ Mono mass: 166.099379691
PHUB001785 Score: 0.806	2,3-Bornanedione metabolite	C₁₀H₁₄O₂ Mono mass: 166.099379691