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DOXEPIN-METABOLITE 3

View entire compound with spectra: 1 MS (GC)

DOXEPIN-METABOLITE 3
SpectraBase Compound ID KxUIKRc9tyU
InChI InChI=1S/C17H16O2/c18-11-5-9-15-14-7-2-1-6-13(14)12-19-17-10-4-3-8-16(15)17/h1-4,6-10,18H,5,11-12H2/b15-9-
InChIKey FEGNMHYYCAOLIK-DHDCSXOGSA-N
Mol Weight 252.31 g/mol
Molecular Formula C17H16O2
Exact Mass 252.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9XFYcbt54IZ
Name DOXEPIN-METABOLITE 3
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C17H16O2
InChI InChI=1S/C17H16O2/c18-11-5-9-15-14-7-2-1-6-13(14)12-19-17-10-4-3-8-16(15)17/h1-4,6-10,18H,5,11-12H2/b15-9-
InChIKey FEGNMHYYCAOLIK-DHDCSXOGSA-N
Instrument Name GC
Molecular Weight 252.313 g/mol
SMILES OCC\C=C/1c2ccccc2OCc2c1cccc2
SPLASH splash10-001r-8970000000-f74484e575d99dbef313
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany