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Venlafaxine-A
SpectraBase Compound ID 2cnMJRLTXcx
InChI InChI=1S/C13H16O/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h4,6-9,14H,1-3,5,10H2
InChIKey JXFHJWAHCHKMQH-UHFFFAOYSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lroFdAoEWO
Name Venlafaxine-A
Classification Pharmaceutical drug, sympathomimetic, antidepressant
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 188.120115134 u
Formula C13H16O
InChI InChI=1S/C13H16O/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h4,6-9,14H,1-3,5,10H2
InChIKey JXFHJWAHCHKMQH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 188.270 g/mol
Nominal Mass 188 u
Quality 831
Retention Index 1411
SMILES OC1=CC=C(CC2=CCCCC2)C=C1
SPLASH splash10-0079-1900000000-c1f2ca098ca8feeada5a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Hydroxybenzyl-cyclohexen
Technique GC/MS
Wiley ID DD2024_004241