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Doxylamine HY
SpectraBase Compound ID pP4VTSDbHW
InChI InChI=1S/C13H13NO/c1-13(15,11-7-3-2-4-8-11)12-9-5-6-10-14-12/h2-10,15H,1H3
InChIKey JZSWVCNVNOZMFN-UHFFFAOYSA-N
Mol Weight 199.25 g/mol
Molecular Formula C13H13NO
Exact Mass 199.099714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUInMMWTH1c
Name Doxylamine HY
Classification Pharmaceutical drug, antihistaminic
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 199.099714042 u
Formula C13H13NO
InChI InChI=1S/C13H13NO/c1-13(15,11-7-3-2-4-8-11)12-9-5-6-10-14-12/h2-10,15H,1H3
InChIKey JZSWVCNVNOZMFN-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 199.253 g/mol
Nominal Mass 199 u
Quality 864
Retention Index 1566
SMILES OC(C=1C=CC=CC1)(C1=NC=CC=C1)C
SPLASH splash10-004i-7900000000-b124bdda9bcc1e44827b
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-Phenyl-1-(pyridin-2-yl)ethan-1-ol
Technique GC/MS
Wiley ID DD2024_001261