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Venlafaxine AC
SpectraBase Compound ID 27xIpsfbDoe
InChI InChI=1S/C19H29NO3/c1-15(21)23-19(12-6-5-7-13-19)18(14-20(2)3)16-8-10-17(22-4)11-9-16/h8-11,18H,5-7,12-14H2,1-4H3
InChIKey JGOQAINEPLQITA-UHFFFAOYSA-N
Mol Weight 319.45 g/mol
Molecular Formula C19H29NO3
Exact Mass 319.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkauXwVlMTg
Name Venlafaxine AC
Classification Pharmaceutical drug derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 319.214743795 u
Formula C19H29NO3
InChI InChI=1S/C19H29NO3/c1-15(21)23-19(12-6-5-7-13-19)18(14-20(2)3)16-8-10-17(22-4)11-9-16/h8-11,18H,5-7,12-14H2,1-4H3
InChIKey JGOQAINEPLQITA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 319.445 g/mol
Nominal Mass 319 u
Quality 920
Retention Index 2401
SMILES C1(C(C2=CC=C(C=C2)OC)CN(C)C)(OC(=O)C)CCCCC1
SPLASH splash10-0udi-2980000000-38854a00d350acfcb260
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2-(dimethylamino)-1-(4-methoxyphenyl)ethyl)cyclohexyl acetate
Technique GC/MS
Wiley ID DD2024_007224