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3,3-Dimethyl-2-oxo-1-bicyclo[2.2.1]heptanesulfonic acid
SpectraBase Compound ID DZTtgYWAOmm
InChI InChI=1S/C9H14O4S/c1-8(2)6-3-4-9(5-6,7(8)10)14(11,12)13/h6H,3-5H2,1-2H3,(H,11,12,13)/t6-,9-/m0/s1
InChIKey ZHTLRKANLGXVEH-RCOVLWMOSA-N
Mol Weight 218.27 g/mol
Molecular Formula C9H14O4S
Exact Mass 218.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Cyr6X9196b
Name 3,3-Dimethyl-2-oxo-1-bicyclo[2.2.1]heptanesulfonic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O4S
InChI InChI=1S/C9H14O4S/c1-8(2)6-3-4-9(5-6,7(8)10)14(11,12)13/h6H,3-5H2,1-2H3,(H,11,12,13)/t6-,9-/m0/s1
InChIKey ZHTLRKANLGXVEH-RCOVLWMOSA-N
Molecular Weight 218.267 g/mol
SMILES OS([C@@]12C(C(C)(C)[C@](C2)(CC1)[H])=O)(=O)=O
SPLASH splash10-0006-9000000000-edfa1d44a8c765d9ceba
Source of Spectrum QC-11-1715-8
Synonyms (1R)-3,3-Dimethyl-2-oxo-1-bicyclo[2.2.1]heptanesulfonic acid 3,3-Dimethyl-2-oxobicyclo[2.2.1]heptane-1-sulfonic acid
Wiley ID 859846