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

*Links on SpectraBase are not permalinks.

(3R,4S,5S)-3-[(2R)-1-benzylpyrrolidin-2-yl]-4-hydroxy-5-(phenylthio)oxepan-2-one

Compound with spectra: 1 MS (GC)

(3R,4S,5S)-3-[(2R)-1-benzylpyrrolidin-2-yl]-4-hydroxy-5-(phenylthio)oxepan-2-one
SpectraBase Compound ID LQN2Mm0upyK
InChI InChI=1S/C23H27NO3S/c25-22-20(28-18-10-5-2-6-11-18)13-15-27-23(26)21(22)19-12-7-14-24(19)16-17-8-3-1-4-9-17/h1-6,8-11,19-22,25H,7,12-16H2/t19-,20+,21-,22-/m1/s1
InChIKey QULBJJFIBRBOMK-CIAFKFPVSA-N
Mol Weight 397.53 g/mol
Molecular Formula C23H27NO3S
Exact Mass 397.171165 g/mol
Enantiomer InChIKey QULBJJFIBRBOMK-LRSLUSHPSA-N

View Spectrum of (3R,4S,5S)-3-[(2R)-1-benzylpyrrolidin-2-yl]-4-hydroxy-5-(phenylthio)oxepan-2-one

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum K1-2004-4226-38
(3RS,4SR,5SR)-3-[(2RS)-N-benzylpiperidin-2-yl]-4-hydroxy-5-phenylthiooxepan-2-one
(3RS,4SR,5SR)-5-Acetoxy-3-[(2RS)-N-benzylpyrrolidin-2-yl]-4-hydroxyoxepan-2-one
(3RS,4SR,5SR)-5-Acetoxy-3-[(2RS)-N-benzylpiperidin-2-yl]-4-hydroxyoxepan-2-one
(3RS,4RS)-3-[(2RS)-N-Benzylpiperidin-2-yl]-4-(imidazol-2-ylthiocarbonyloxy)oxepan-2-one
(5RS,5aRS,11aSR,11bSR)-5-Bromodecahydro-1H-oxepino[3',4':4,5]isoxazolo[2,3-a]pyridin-1-one
9-Benzyl-5-oxa-9-azatricyclo[5.2.1.0(4,8)]decane-6-one
9-BENZYL-5-OXA-9-AZATRICYCLO-[5.2.1.0(4,8)]-DECAN-6-ONE
2,6-DIPHENYL-4-HYDROXY-1-METHYL-3,5-PIPERIDINEDICARBOXYLIC ACID, DIETHYL ESTER
Cocaethylene-M TBDMS @
Cocaine-M/artifact ACTBDMS @
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.