For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,7R)-2-Methyl-7-[2'-(1",3"-dioxan-2"-yl)ethyl]-azepane
SpectraBase Compound ID Ib3rv3hxpDT
InChI InChI=1S/C13H25NO2/c1-11-5-2-3-6-12(14-11)7-8-13-15-9-4-10-16-13/h11-14H,2-10H2,1H3/t11-,12+/m0/s1
InChIKey IZYOMQKDAAXKIH-NWDGAFQWSA-N
Mol Weight 227.35 g/mol
Molecular Formula C13H25NO2
Exact Mass 227.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HCbQFc6UipV
Name (2S,7R)-2-Methyl-7-[2'-(1",3"-dioxan-2"-yl)ethyl]-azepane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H25NO2
InChI InChI=1S/C13H25NO2/c1-11-5-2-3-6-12(14-11)7-8-13-15-9-4-10-16-13/h11-14H,2-10H2,1H3/t11-,12+/m0/s1
InChIKey IZYOMQKDAAXKIH-NWDGAFQWSA-N
Molecular Weight 227.348 g/mol
SMILES N1[C@](CCCC[C@@]1(CCC1OCCCO1)[H])(C)[H]
SPLASH splash10-03di-6900000000-2d432b476e8922b9a4f5
Source of Spectrum G4-64-426-14
Synonyms (2R,7S)-2-[2-(1,3-dioxan-2-yl)ethyl]-7-methylhexahydro-1H-azepine (trans)-2-Methyl-7-[3'-(1'',3''-dioxan-2''-yl)propyl]-azepane
Wiley ID 1608871