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Noxiptilin
SpectraBase Compound ID 6ChrbpiFjf
InChI InChI=1S/C19H22N2O/c1-21(2)13-14-22-20-19-17-9-5-3-7-15(17)11-12-16-8-4-6-10-18(16)19/h3-10H,11-14H2,1-2H3
InChIKey GPTURHKXTUDRPC-UHFFFAOYSA-N
Mol Weight 294.4 g/mol
Molecular Formula C19H22N2O
Exact Mass 294.173213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFganBLvNTs
Name Noxiptiline
CAS Registry Number 3362-45-6
Classification Pharmaceutical drug, tricyclic antidepressant
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 294.173213335 u
Formula C19H22N2O
InChI InChI=1S/C19H22N2O/c1-21(2)13-14-22-20-19-17-9-5-3-7-15(17)11-12-16-8-4-6-10-18(16)19/h3-10H,11-14H2,1-2H3
InChIKey GPTURHKXTUDRPC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 294.398 g/mol
Nominal Mass 294 u
Quality 1000
Retention Index 2247
SMILES C1(C2=C(CCC3=C1C=CC=C3)C=CC=C2)=NOCCN(C)C
SPLASH splash10-0a4i-9010000000-f21700339b5afc0ea981
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Agedal Noxiptilin Noxiptyline 10,11-Dihydro-5H-dibenzo(a,d)cyclohepten-5-one-O-(2-(dimethylamino)ethyl)oxime
Technique GC/MS
Wiley ID DD2024_022392