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

*Links on SpectraBase are not permalinks.
Ethyl (.alpha.(.xi.),.beta.(.xi.))-.alpha.-[(1.xi.,3S,5R)-3,5-Dimethyl-2-methylenecyclopentyl]-.beta.-hydroxy-.alpha.-methyl-1-(phenylsulfonyl)-1H-pyrrole-3-propanoate
SpectraBase Compound ID KEbvF2tDqEV
InChI InChI=1S/C24H31NO5S/c1-6-30-23(27)24(5,21-17(3)14-16(2)18(21)4)22(26)19-12-13-25(15-19)31(28,29)20-10-8-7-9-11-20/h7-13,15-17,21-22,26H,4,6,14H2,1-3,5H3/t16-,17+,21?,22?,24?/m0/s1
InChIKey MFRDESYAEJCLRB-HZJWEHDYSA-N
Mol Weight 445.57 g/mol
Molecular Formula C24H31NO5S
Exact Mass 445.192294 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 HVGNMkfGo66
Name Ethyl (.alpha.(.xi.),.beta.(.xi.))-.alpha.-[(1.xi.,3S,5R)-3,5-Dimethyl-2-methylenecyclopentyl]-.beta.-hydroxy-.alpha.-methyl-1-(phenylsulfonyl)-1H-pyrrole-3-propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H31NO5S
InChI InChI=1S/C24H31NO5S/c1-6-30-23(27)24(5,21-17(3)14-16(2)18(21)4)22(26)19-12-13-25(15-19)31(28,29)20-10-8-7-9-11-20/h7-13,15-17,21-22,26H,4,6,14H2,1-3,5H3/t16-,17+,21?,22?,24?/m0/s1
InChIKey MFRDESYAEJCLRB-HZJWEHDYSA-N
Molecular Weight 445.574 g/mol
SMILES OC(C(C1C([C@@](C)(C[C@]1(C)[H])[H])=C)(C(=O)OCC)C)c1c[n](S(=O)(=O)c2ccccc2)cc1
SPLASH splash10-004i-9420000000-1bb6ad45b96b6e283003
Source of Spectrum E1-42-860-24
Wiley ID 1552554