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

*Links on SpectraBase are not permalinks.
(1R*,4R*,5R*,6S*)-2-Thiabicyclo[2.2.2]octan-8-one-5,6-dicarboxylic Acid Imide
SpectraBase Compound ID GNTfU0qwnbL
InChI InChI=1S/C9H9NO3S/c11-4-1-5-7-6(3(4)2-14-5)8(12)10-9(7)13/h3,5-7H,1-2H2,(H,10,12,13)/t3-,5+,6+,7-/m0/s1
InChIKey SUSNTJPLEIAJRP-HJEFZAFNSA-N
Mol Weight 211.23 g/mol
Molecular Formula C9H9NO3S
Exact Mass 211.030314 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 Eb5np4zLjo3
Name (1R*,4R*,5R*,6S*)-2-Thiabicyclo[2.2.2]octan-8-one-5,6-dicarboxylic Acid Imide
Alternate Name(s) (1R,2R,6S,7R)-8-thia-4-azatricyclo[5.2.2.0(2,6)]undecane-3,5,10-trione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9NO3S
InChI InChI=1S/C9H9NO3S/c11-4-1-5-7-6(3(4)2-14-5)8(12)10-9(7)13/h3,5-7H,1-2H2,(H,10,12,13)/t3-,5+,6+,7-/m0/s1
InChIKey SUSNTJPLEIAJRP-HJEFZAFNSA-N
Molecular Weight 211.235 g/mol
SMILES N1C([C@@]2([C@](C1=O)([C@]1(CS[C@@]2(CC1=O)[H])[H])[H])[H])=O
SPLASH splash10-03di-4980000000-b29ae8834115dc04e3d1
Source of Spectrum I-69-1492-4
Wiley ID 1210174