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Opipramol AC
SpectraBase Compound ID FCV9JtD1VmC
InChI InChI=1S/C25H31N3O2/c1-21(29)30-20-19-27-17-15-26(16-18-27)13-6-14-28-24-9-4-2-7-22(24)11-12-23-8-3-5-10-25(23)28/h2-5,7-12H,6,13-20H2,1H3
InChIKey NWLAEDVHSHAIBK-UHFFFAOYSA-N
Mol Weight 405.54 g/mol
Molecular Formula C25H31N3O2
Exact Mass 405.241627 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4e0xvCeFd9M
Name 5-[3-(4-(2-Acetoxyethyl)piperazinyl)propyl]-5H-dibenzo[b,f]azepine
CAS Registry Number 17601-56-8
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 405.241627248 u
Formula C25H31N3O2
InChI InChI=1S/C25H31N3O2/c1-21(29)30-20-19-27-17-15-26(16-18-27)13-6-14-28-24-9-4-2-7-22(24)11-12-23-8-3-5-10-25(23)28/h2-5,7-12H,6,13-20H2,1H3
InChIKey NWLAEDVHSHAIBK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 405.542 g/mol
Nominal Mass 405 u
Quality 997
SMILES C=12N(C3=C(C=CC2=CC=CC1)C=CC=C3)CCCN1CCN(CC1)CCOC(=O)C
SPLASH splash10-0a4i-8890100000-5a5908592985c4d4a7ab
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(4-(3-(5H-dibenzo[b,f]azepin-5-yl)propyl)piperazin-1-yl)ethyl acetate
Technique GC/MS
Wiley ID DD2024_034633