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

*Links on SpectraBase are not permalinks.
[(1R*,3R*,5R*)-3-Phenyl-2-(4-methylbenzenesulfonyl)-2-azabicyclo[3.1.0]hex-1-yl]ethanal
SpectraBase Compound ID L19D6elAyuh
InChI InChI=1S/C20H21NO3S/c1-15-7-9-18(10-8-15)25(23,24)21-19(16-5-3-2-4-6-16)13-17-14-20(17,21)11-12-22/h2-10,12,17,19H,11,13-14H2,1H3/t17-,19-,20+/m1/s1
InChIKey GHPGFGUREKZPEZ-RLLQIKCJSA-N
Mol Weight 355.45 g/mol
Molecular Formula C20H21NO3S
Exact Mass 355.124215 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 8Hwm3j8pi0W
Name [(1R*,3R*,5R*)-3-Phenyl-2-(4-methylbenzenesulfonyl)-2-azabicyclo[3.1.0]hex-1-yl]ethanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO3S
InChI InChI=1S/C20H21NO3S/c1-15-7-9-18(10-8-15)25(23,24)21-19(16-5-3-2-4-6-16)13-17-14-20(17,21)11-12-22/h2-10,12,17,19H,11,13-14H2,1H3/t17-,19-,20+/m1/s1
InChIKey GHPGFGUREKZPEZ-RLLQIKCJSA-N
Molecular Weight 355.452 g/mol
SMILES [C@@]12(N([C@](C[C@]2([H])C1)(c1ccccc1)[H])S(c1ccc(cc1)C)(=O)=O)CC=O
SPLASH splash10-0gwf-4930000000-b6c5f690996bc444682e
Source of Spectrum F-65-1830-72
Wiley ID 1681660