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ALCOHOL-#6
SpectraBase Compound ID JThN5FtLMoR
InChI InChI=1S/C8H12O3S/c1-12(10,11)8-3-4-2-5(8)6(8)7(4)9/h4-7,9H,2-3H2,1H3/t4-,5-,6-,7-,8+/m1/s1
InChIKey VOJVHYOBHIGLBN-PVFLNQBWSA-N
Mol Weight 188.24 g/mol
Molecular Formula C8H12O3S
Exact Mass 188.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Eg8TP3KGF9
Name 5-(Methylsulfonyl)bicyclo[2.2.1]heptane2-ol
CAS Registry Number 139689-88-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12O3S
InChI InChI=1S/C8H12O3S/c1-12(10,11)8-3-4-2-5(8)6(8)7(4)9/h4-7,9H,2-3H2,1H3/t4-,5-,6-,7-,8+/m1/s1
InChIKey VOJVHYOBHIGLBN-PVFLNQBWSA-N
Molecular Weight 188.241 g/mol
SMILES O[C@]1([C@@]2([C@]3([C@@]2(C[C@@]1(C3)[H])[H])S(=O)(=O)C)[H])[H]
SPLASH splash10-0a6r-8900000000-d9a55cd830de29864527
Source of Spectrum J-57-2686-6
Wiley ID 1184235