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

*Links on SpectraBase are not permalinks.
(3aS,7aS,9aR)-6-methyl-1-[(4-methylphenyl)sulfonyl]-1,2,4,7,7a,8,9,9a-octahydro-3H-indeno[1,7a-b]pyrrol-3-one
SpectraBase Compound ID 5fQA2NRnNzV
InChI InChI=1S/C19H23NO3S/c1-13-3-6-16(7-4-13)24(22,23)20-12-18(21)19-10-9-14(2)11-15(19)5-8-17(19)20/h3-4,6-7,9,15,17H,5,8,10-12H2,1-2H3/t15-,17+,19-/m0/s1
InChIKey DITBELGHRDCPJC-WDYCEAGBSA-N
Mol Weight 345.46 g/mol
Molecular Formula C19H23NO3S
Exact Mass 345.139865 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 3rM6mLohvnb
Name (3aS,7aS,9aR)-6-methyl-1-[(4-methylphenyl)sulfonyl]-1,2,4,7,7a,8,9,9a-octahydro-3H-indeno[1,7a-b]pyrrol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23NO3S
InChI InChI=1S/C19H23NO3S/c1-13-3-6-16(7-4-13)24(22,23)20-12-18(21)19-10-9-14(2)11-15(19)5-8-17(19)20/h3-4,6-7,9,15,17H,5,8,10-12H2,1-2H3/t15-,17+,19-/m0/s1
InChIKey DITBELGHRDCPJC-WDYCEAGBSA-N
Molecular Weight 345.457 g/mol
SMILES [C@@]12(N(S(c3ccc(C)cc3)(=O)=O)CC([C@@]11[C@](CC(=CC1)C)(CC2)[H])=O)[H]
SPLASH splash10-001l-1900000000-245239f821e84be916b1
Source of Spectrum F5-6-3131-27
Synonyms 6-Methyl-1-tosyl-2,3,4,7,7a,8,9,9a-octahydro-1H-indeno[1,7a-b]pyrrol-3-one (3aR,5aS,9aS)-7-methyl-3-tosyl-2,3,3a,4,5,5a,6,9-octahydro-1H-indeno[1,7a-b]pyrrol-1-one
Wiley ID 1733568