| SpectraBase Compound ID | DdhIfAzIfsU |
|---|---|
| InChI | InChI=1S/C12H17N4OS.ClH/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);1H/q+1;/p-1 |
| InChIKey | MYVIATVLJGTBFV-UHFFFAOYSA-M |
| Mol Weight | 300.81 g/mol |
| Molecular Formula | C12H17ClN4OS |
| Exact Mass | 300.08116 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7e5cLJOfxJ2 |
|---|---|
| Name | THIAMINE,HYDROCHLORIDE |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C12H17ClN4OS |
| InChI | InChI=1S/C12H17N4OS.ClH/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13;/h5,7,17H,3-4,6H2,1-2H3,(H2,13,14,15);1H/q+1;/p-1 |
| InChIKey | MYVIATVLJGTBFV-UHFFFAOYSA-M |
| Literature Reference Author | R.E.ECHOLS,G.C.LEVY |
| Literature Reference Citation | J.ORG.CHEM.,39,1321(1974) |
| Literature Reference DOI | 10.1021/jo00923a040 |
| Molecular Weight | 300.806 g/mol |
| Solvent | CH3OH:H2O |
| Source File Reference | UNIW20932 |