SpectraBase Spectrum ID |
8i44sk21SJI |
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 |
962 |
Retention Index |
2401 |
SMILES |
C1(C(C2=CC=C(C=C2)OC)CN(C)C)(OC(=O)C)CCCCC1 |
SPLASH |
splash10-0zfr-5950000000-56b3c2d3bffbd121919a |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
1-(2-(dimethylamino)-1-(4-methoxyphenyl)ethyl)cyclohexyl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_004240 |