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Venlafaxine-M/A (-CH3,H2O) AC
SpectraBase Compound ID 41m2e7BpRgj
InChI InChI=1S/C18H25NO2/c1-14(20)19(2)13-18(15-7-5-4-6-8-15)16-9-11-17(21-3)12-10-16/h7,9-12,18H,4-6,8,13H2,1-3H3
InChIKey KGDVLZIFWBVNQJ-UHFFFAOYSA-N
Mol Weight 287.4 g/mol
Molecular Formula C18H25NO2
Exact Mass 287.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8J9W8AT6iGG
Name Venlafaxine-M/A (-CH3,H2O) AC
Classification Pharmaceutical drug metabolite/ artifact derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 287.188529047 u
Formula C18H25NO2
InChI InChI=1S/C18H25NO2/c1-14(20)19(2)13-18(15-7-5-4-6-8-15)16-9-11-17(21-3)12-10-16/h7,9-12,18H,4-6,8,13H2,1-3H3
InChIKey KGDVLZIFWBVNQJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 287.403 g/mol
Nominal Mass 287 u
Quality 949
Retention Index 2180
SMILES C(C=1C=CC(=CC1)OC)(C1=CCCCC1)CN(C(=O)C)C
SPLASH splash10-0w2c-5980000000-71846307aa3582693051
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(2-(Cyclohex-1-en-1-yl)-2-(4-methoxyphenyl)ethyl)-N-methylacetamide
Technique GC/MS
Wiley ID DD2024_024573