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

*Links on SpectraBase are not permalinks.
(4S,5S)-2-[1,1-Bis(methylthio)-3-(N-benzenesulfonyl-N-methylamino)pentyl]-4-methyl-5-phenyl-1,3-oxazoline
SpectraBase Compound ID BYyf8hIrtOv
InChI InChI=1S/C24H32N2O3S3/c1-6-20(26(3)32(27,28)21-15-11-8-12-16-21)17-24(30-4,31-5)23-25-18(2)22(29-23)19-13-9-7-10-14-19/h7-16,18,20,22H,6,17H2,1-5H3/t18-,20?,22+/m0/s1
InChIKey RCCUAXPDFTYOEB-VRTQEHCBSA-N
Mol Weight 492.7 g/mol
Molecular Formula C24H32N2O3S3
Exact Mass 492.157506 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 4U6mBYiSUCK
Name (4S,5S)-2-[1,1-Bis(methylthio)-3-(N-benzenesulfonyl-N-methylamino)pentyl]-4-methyl-5-phenyl-1,3-oxazoline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32N2O3S3
InChI InChI=1S/C24H32N2O3S3/c1-6-20(26(3)32(27,28)21-15-11-8-12-16-21)17-24(30-4,31-5)23-25-18(2)22(29-23)19-13-9-7-10-14-19/h7-16,18,20,22H,6,17H2,1-5H3/t18-,20?,22+/m0/s1
InChIKey RCCUAXPDFTYOEB-VRTQEHCBSA-N
Molecular Weight 492.711 g/mol
SMILES C(N(S(=O)(=O)c1ccccc1)C)(CC(C1=N[C@@](C)([C@@](O1)(c1ccccc1)[H])[H])(SC)SC)CC
SPLASH splash10-005c-9300000000-cd8fc0d76dac43335afb
Source of Spectrum QC-8-2442-8
Synonyms N-[1-ethyl-3-[(4S,5S)-4-methyl-5-phenyl-4,5-dihydro-1,3-oxazol-2-yl]-3,3-bis(methylsulfanyl)propyl]-N-methylbenzenesulfonamide
Wiley ID 870031