SpectraBase Spectrum ID |
4KpbNxK7jE |
Name |
Trimipramine-M 3AC |
Classification |
Antidepressant |
Comments |
Structure comment: Wiggly bond = unknown position of substituent |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
424.199822005 u |
Formula |
C24H28N2O5 |
InChI |
InChI=1S/C24H28N2O5/c1-15(13-25-16(2)27)14-26-21-8-6-5-7-19(21)9-10-20-11-23(30-17(3)28)24(12-22(20)26)31-18(4)29/h5-8,11-12,15H,9-10,13-14H2,1-4H3,(H,25,27) |
InChIKey |
KRWKPGSKINXAED-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
424.497 g/mol |
SMILES |
C1Cc2cc(OC(C)=O)c(OC(C)=O)cc2N(CC(C)CNC(=O)C)c2ccccc12 |
SPLASH |
splash10-00di-2469100000-97b9bddc41fc33f0dcaa |
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: U+UHYAC |
Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
Synonyms |
Trimipramine-M (bis-nor-di-HO-) 3AC |
Technique |
GC/MS |
Wiley ID |
MMPW6e_2856 |