SpectraBase Compound ID | 2lvKWQONmWZ |
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InChI | InChI=1S/C8H12O2S/c9-8-4-1-2-6-5(10-4)3-7(8)11-6/h4-9H,1-3H2/t4-,5-,6-,7-,8+/m1/s1 |
InChIKey | AMUGMIMMAYCVRX-PVFLNQBWSA-N |
Mol Weight | 172.24 g/mol |
Molecular Formula | C8H12O2S |
Exact Mass | 172.055801 g/mol |
SpectraBase Spectrum ID | GZq7bXFDYSh |
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Name | |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C8H12O2S |
InChI | InChI=1S/C8H12O2S/c9-8-4-1-2-6-5(10-4)3-7(8)11-6/h4-9H,1-3H2/t4-,5-,6-,7-,8+/m1/s1 |
InChIKey | AMUGMIMMAYCVRX-PVFLNQBWSA-N |
Molecular Weight | 172.0555 |
SMILES | O[C@@]1([C@@]2(S[C@@]3(CC[C@]1(O[C@@]3(C2)[H])[H])[H])[H])[H] |
SPLASH | splash10-000i-9100000000-2e4e35f41d1a3cbe7e25 |
Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |