| SpectraBase Compound ID | IvNu40OU6xb |
|---|---|
| InChI | InChI=1S/C10H11NS/c1-7-4-8(2)10(11-6-12)9(3)5-7/h4-5H,1-3H3 |
| InChIKey | KKYMYPLVBCVDPL-UHFFFAOYSA-N |
| Mol Weight | 177.26 g/mol |
| Molecular Formula | C10H11NS |
| Exact Mass | 177.061221 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7MGJy521o8C |
|---|---|
| Name | BENZENE, 2-ISOTHIOCYANATO-1,3,5-TRIMETHYL- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H11NS |
| InChI | InChI=1S/C10H11NS/c1-7-4-8(2)10(11-6-12)9(3)5-7/h4-5H,1-3H3 |
| InChIKey | KKYMYPLVBCVDPL-UHFFFAOYSA-N |
| Molecular Weight | 177.0610 |
| SMILES | c1(C)cc(C)c(N=C=S)c(C)c1 |
| SPLASH | splash10-004i-2900000000-a85803a796d48b58fe3e |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |