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Varenicline

View entire compound with spectra: 3 MS (GC)

Varenicline
SpectraBase Compound ID BxOvHOTJaHu
InChI InChI=1S/C13H13N3/c1-2-16-13-5-11-9-3-8(6-14-7-9)10(11)4-12(13)15-1/h1-2,4-5,8-9,14H,3,6-7H2/t8-,9+
InChIKey JQSHBVHOMNKWFT-DTORHVGOSA-N
Mol Weight 211.27 g/mol
Molecular Formula C13H13N3
Exact Mass 211.110947 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DLNGNXSL20w
Name Varenicline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N3
InChI InChI=1S/C13H13N3/c1-2-16-13-5-11-9-3-8(6-14-7-9)10(11)4-12(13)15-1/h1-2,4-5,8-9,14H,3,6-7H2/t8-,9+
InChIKey JQSHBVHOMNKWFT-DTORHVGOSA-N
Molecular Weight 211.268 g/mol
SMILES N1C[C@]2(c3cc4c(cc3[C@@](C1)(C2)[H])nccn4)[H]
SPLASH splash10-014i-1900000000-dc0c8e7b99b9d82c7fad
Source of Spectrum SWG-33-1165-0
Synonyms Chantix Champix 7,8,9,10-tetrahydro- 6,10-methano- 6H-pyrazino (2,3-h)(3) benzazepine (6R,10S)-7,8,9,10-tetrahydro-6H-6,10-methanoazepino[4,5-g]quinoxaline
Wiley ID 1809052