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

*Links on SpectraBase are not permalinks.
(+)-(1R,2S,5R,6R,7S)-5-ethyl-4-[(1'R)-1'-phenyl-2'-hydroxy-ethyl]-4 azatricyclo[5.2.1.0(2,6)]dec-8-en-3-one
SpectraBase Compound ID ie28qXTABs
InChI InChI=1S/C19H23NO2/c1-2-15-17-13-8-9-14(10-13)18(17)19(22)20(15)16(11-21)12-6-4-3-5-7-12/h3-9,13-18,21H,2,10-11H2,1H3/t13-,14+,15-,16+,17+,18+/m1/s1
InChIKey GIEGXNDWAXXPEY-UFYUIRFASA-N
Mol Weight 297.4 g/mol
Molecular Formula C19H23NO2
Exact Mass 297.172879 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 45aP7FsEmtK
Name (+)-(1R,2S,5R,6R,7S)-5-ethyl-4-[(1'R)-1'-phenyl-2'-hydroxy-ethyl]-4 azatricyclo[5.2.1.0(2,6)]dec-8-en-3-one
Appearance White crystals
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO2
InChI InChI=1S/C19H23NO2/c1-2-15-17-13-8-9-14(10-13)18(17)19(22)20(15)16(11-21)12-6-4-3-5-7-12/h3-9,13-18,21H,2,10-11H2,1H3/t13-,14+,15-,16+,17+,18+/m1/s1
InChIKey GIEGXNDWAXXPEY-UFYUIRFASA-N
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0005.906
Molecular Weight 297.398 g/mol
Optical Rotation [a]D20 = +129.3 (c = 1.37, CHCl3)
SMILES OC[C@](N1[C@@]([C@]2([C@]([C@@]3(C[C@]2(C=C3)[H])[H])(C1=O)[H])[H])(CC)[H])(c1ccccc1)[H]
SPLASH splash10-0uxr-0290000000-b8e84b7b1b3165f57612
Source of Spectrum ARK-2004-40-4b
Wiley ID 1876057