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2-Methoxyphenylacetic acid
  Mrv2104 06072104282D

12 12  0  0  0  0            999 V2000
    4.4484   -1.5373    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7339   -0.2997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4484    0.1128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7340   -1.1248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0195    0.1128    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0195   -1.5373    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3050   -0.2998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3050   -1.1248    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4484   -2.3623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1629   -0.2997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8774    0.1128    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1629   -1.1247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  4  1  0  0  0  0
  1  9  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  2  5  2  0  0  0  0
  4  6  2  0  0  0  0
  5  7  1  0  0  0  0
  6  8  1  0  0  0  0
  7  8  2  0  0  0  0
  3 10  1  0  0  0  0
 10 11  1  0  0  0  0
 10 12  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 — 3 of approximately 3 results

PHUB001130 Score: 1.0	2-Methoxyphenylacetic acid metabolite	C₉H₁₀O₃ Mono mass: 166.062994182
PHUB001830 Score: 0.753	2-(2-hydroxy-4-methylphenyl)propionic acid metabolite	C₁₀H₁₂O₃ Mono mass: 180.078644246
PHUB002138 Score: 0.713	3'-Methoxyphenylacetic acid metabolite	C₉H₁₀O₃ Mono mass: 166.062994182