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Doxylamine-M (-C4H11NO)
SpectraBase Compound ID 5Mz3cskoSB5
InChI InChI=1S/C13H11N/c1-11(12-7-3-2-4-8-12)13-9-5-6-10-14-13/h2-10H,1H2
InChIKey WLFQFTSISRWCNV-UHFFFAOYSA-N
Mol Weight 181.24 g/mol
Molecular Formula C13H11N
Exact Mass 181.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HrCsSSxyD2
Name Doxylamine-M (-C4H11NO)
CAS Registry Number 15260-65-8
Classification Pharmaceutical drug metabolite
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 181.089149358 u
Formula C13H11N
InChI InChI=1S/C13H11N/c1-11(12-7-3-2-4-8-12)13-9-5-6-10-14-13/h2-10H,1H2
InChIKey WLFQFTSISRWCNV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 181.238 g/mol
Nominal Mass 181 u
Quality 954
Retention Index 1446
SMILES C(C1=CC=CC=C1)(C1=NC=CC=C1)=C
SPLASH splash10-001i-2900000000-4bfc93c837b8845e35f1
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(1-Phenylethenyl)pyridine
Technique GC/MS
Wiley ID DD2024_033604