| SpectraBase Spectrum ID |
BrKyvFJwesQ |
| Name |
Doxepin |
| CAS Registry Number |
1668-19-5 |
| Classification |
Antidepressant |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
279.162314299 u |
| Formula |
C19H21NO |
| InChI |
InChI=1S/C19H21NO/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11- |
| InChIKey |
ODQWQRRAPPTVAG-BOPFTXTBSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
279.383 g/mol |
| SMILES |
C1c2c(\C(=C\CCN(C)C)c3c(cccc3)O1)cccc2 |
| SPLASH |
splash10-0a4i-9300000000-18c6d2a755c3444c6e08 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: P-I G U+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_332 |
![(3Z)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethyl-1-propanamine](/api/spectrum/BrKyvFJwesQ/structure.png?h=300&w=458 "(3Z)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)-N,N-dimethyl-1-propanamine")
