| SpectraBase Compound ID | Craya2HQifc |
|---|---|
| InChI | InChI=1S/C9H12O2S/c1-3-12(10,11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3 |
| InChIKey | XBZQMVYXYKDYPA-UHFFFAOYSA-N |
| Mol Weight | 184.25 g/mol |
| Molecular Formula | C9H12O2S |
| Exact Mass | 184.055801 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 3n2p9a0P9i0 |
|---|---|
| Name | BENZENE, 4-(ETHYLSULFONYL)-1-METHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C9H12O2S |
| InChI | InChI=1S/C9H12O2S/c1-3-12(10,11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3 |
| InChIKey | XBZQMVYXYKDYPA-UHFFFAOYSA-N |
| Instrument Name | 311A |
| Molecular Weight | 184.0555 |
| SMILES | c1(S(=O)(=O)CC)ccc(C)cc1 |
| SPLASH | splash10-052f-9700000000-21927e356083f74257d8 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |