| SpectraBase Compound ID | Da9Gssq53wv |
|---|---|
| InChI | InChI=1S/C12H17N3O2S.ClH/c1-4-18-12(13)15-14-8-9-5-10(16-2)7-11(6-9)17-3;/h5-8H,4H2,1-3H3,(H2,13,15);1H/b14-8+; |
| InChIKey | RKZRQWYCPDZTDA-XHIXCECLSA-N |
| Mol Weight | 303.81 g/mol |
| Molecular Formula | C12H18ClN3O2S |
| Exact Mass | 303.080826 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I8JzcD7usGf |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C12H18ClN3O2S |
| InChI | InChI=1S/C12H17N3O2S.ClH/c1-4-18-12(13)15-14-8-9-5-10(16-2)7-11(6-9)17-3;/h5-8H,4H2,1-3H3,(H2,13,15);1H/b14-8+; |
| InChIKey | RKZRQWYCPDZTDA-XHIXCECLSA-N |
| Molecular Weight | 303.0805 |
| SMILES | Cl.N\C(SCC)=N\N=C\c1cc(OC)cc(OC)c1 |
| SPLASH | splash10-02t9-6930000000-cdac0a6b9490261c0480 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |