| SpectraBase Compound ID | 2dPRjQ0vdzG |
|---|---|
| InChI | InChI=1S/C18H26O3S/c1-15-5-7-16(8-6-15)22(19,20)21-14-13-18(4)11-9-17(2,3)10-12-18/h5-9,11H,10,12-14H2,1-4H3 |
| InChIKey | QPQSTFANPCKWRP-UHFFFAOYSA-N |
| Mol Weight | 322.46 g/mol |
| Molecular Formula | C18H26O3S |
| Exact Mass | 322.160266 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CxZWNXA7hYt |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula | C18H26O3S |
| InChI | InChI=1S/C18H26O3S/c1-15-5-7-16(8-6-15)22(19,20)21-14-13-18(4)11-9-17(2,3)10-12-18/h5-9,11H,10,12-14H2,1-4H3 |
| InChIKey | QPQSTFANPCKWRP-UHFFFAOYSA-N |
| Molecular Weight | 322.1596 |
| SMILES | C1(C)(C)C=CC(C)(CCOS(c2ccc(C)cc2)(=O)=O)CC1 |
| SPLASH | splash10-00di-6900000000-970cc0cec79b36f9699a |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |