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Opipramol-M (OH) 2AC I
SpectraBase Compound ID 3iVx8i0Hxos
InChI InChI=1S/C27H33N3O4/c1-21(31)33-19-18-29-16-14-28(15-17-29)12-5-13-30-26-7-4-3-6-23(26)8-9-24-20-25(34-22(2)32)10-11-27(24)30/h3-4,6-11,20H,5,12-19H2,1-2H3
InChIKey ZQTQGWOHMIZESE-UHFFFAOYSA-N
Mol Weight 463.6 g/mol
Molecular Formula C27H33N3O4
Exact Mass 463.247107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HAUxLDex5k
Name Opipramol-M (OH) 2AC I
Classification Pharmaceutical drug, sympathomimetic, antidepressant
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 463.247106551 u
Formula C27H33N3O4
InChI InChI=1S/C27H33N3O4/c1-21(31)33-19-18-29-16-14-28(15-17-29)12-5-13-30-26-7-4-3-6-23(26)8-9-24-20-25(34-22(2)32)10-11-27(24)30/h3-4,6-11,20H,5,12-19H2,1-2H3
InChIKey ZQTQGWOHMIZESE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 463.578 g/mol
Nominal Mass 463 u
Quality 936
Retention Index 3662
SMILES C1=2N(C=3C(C=CC2C=C(C=C1)OC(=O)C)=CC=CC3)CCCN1CCN(CC1)CCOC(=O)C
SPLASH splash10-022i-5790200000-79b462ddc834116b33bc
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(4-(3-(2-(acetyloxy)-5H-dibenzo[b,f]azepin-5-yl)propyl)piperazin-1-yl)ethyl acetate
Technique GC/MS
Wiley ID DD2024_006201