| SpectraBase Compound ID | 3CdHMqHvS7R |
|---|---|
| InChI | InChI=1S/C8H12O.C2H4OS/c1-3-7-5-2-6-8(4-1)9-7;1-2(3)4/h1,3,7-8H,2,4-6H2;1H3,(H,3,4)/t7-,8+;/m1./s1 |
| InChIKey | KMWBPELKVUNMNI-WLYNEOFISA-N |
| Mol Weight | 200.3 g/mol |
| Molecular Formula | C10H16O2S |
| Exact Mass | 200.087101 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JUt7Y9SbCto |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C10H14O2S |
| InChI | InChI=1S/C8H12O.C2H4OS/c1-3-7-5-2-6-8(4-1)9-7;1-2(3)4/h1,3,7-8H,2,4-6H2;1H3,(H,3,4)/t7-,8+;/m1./s1 |
| InChIKey | KMWBPELKVUNMNI-WLYNEOFISA-N |
| Molecular Weight | 200.0867 |
| SMILES | SC(C)=O.C1C[C@@]2(CC=C[C@](C1)(O2)[H])[H] |
| SPLASH | splash10-0a4l-9400000000-a3734a0ebf5fcb82041e |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |