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

*Links on SpectraBase are not permalinks.
1H,3H-Pyrrolo[1,2-c]oxazol-1-one, 3-(1,1-dimethylethyl)tetrahydro-7a-(phenylthio)-, (3R-cis)-
SpectraBase Compound ID FJFKReS6MFt
InChI InChI=1S/C16H21NO2S/c1-15(2,3)13-17-11-7-10-16(17,14(18)19-13)20-12-8-5-4-6-9-12/h4-6,8-9,13H,7,10-11H2,1-3H3/t13-,16-/m1/s1
InChIKey JLVPIMLYVSTVHD-CZUORRHYSA-N
Mol Weight 291.41 g/mol
Molecular Formula C16H21NO2S
Exact Mass 291.1293 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 7HowQL0c1Hk
Name 1H,3H-Pyrrolo[1,2-c]oxazol-1-one, 3-(1,1-dimethylethyl)tetrahydro-7a-(phenylthio)-, (3R-cis)-
CAS Registry Number 86046-17-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO2S
InChI InChI=1S/C16H21NO2S/c1-15(2,3)13-17-11-7-10-16(17,14(18)19-13)20-12-8-5-4-6-9-12/h4-6,8-9,13H,7,10-11H2,1-3H3/t13-,16-/m1/s1
InChIKey JLVPIMLYVSTVHD-CZUORRHYSA-N
Molecular Weight 291.409 g/mol
SMILES [C@@]12(N([C@@](C(C)(C)C)(OC2=O)[H])CCC1)Sc1ccccc1
SPLASH splash10-03di-0930000000-73aec28dbca68ea9be3d
Source of Spectrum C-105-5396-0
Synonyms (2R,5R)-2-tert-butyl-5-(phenylthio)-1-aza-3-oxabicyclo[3.3.0]octan-4-one (3R,7aR)-3-tert-butyl-7a-(phenylsulfanyl)tetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-1-one (3R,7aR)-3-tert-butyl-7a-phenylsulfanyl-3,5,6,7-tetrahydropyrrolo[1,2-c]oxazol-1-one (3R,7aR)-3-tert-butyl-7a-phenylsulfanyl-3,5,6,7-tetrahydropyrrolo[1,2-c][1,3]oxazol-1-one
Wiley ID 1294529