SpectraBase Compound ID | 8VhaHE1Ebm3 |
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InChI | InChI=1S/C16H19N3O5S/c1-22-12-4-9(5-13(23-2)14(12)24-3)15(25)19-11(16(20)21)6-10-7-17-8-18-10/h4-5,7-8,11H,6H2,1-3H3,(H,17,18)(H,19,25)(H,20,21) |
InChIKey | JXIQTKSCCPSDAE-UHFFFAOYSA-N |
Mol Weight | 365.4 g/mol |
Molecular Formula | C16H19N3O5S |
Exact Mass | 365.104542 g/mol |
SpectraBase Spectrum ID | IAneqYGu5tw |
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Name | N-(3,4,5-trimethoxythiobenzoyl)histidine |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C16H19N3O5S |
InChI | InChI=1S/C16H19N3O5S/c1-22-12-4-9(5-13(23-2)14(12)24-3)15(25)19-11(16(20)21)6-10-7-17-8-18-10/h4-5,7-8,11H,6H2,1-3H3,(H,17,18)(H,19,25)(H,20,21) |
InChIKey | JXIQTKSCCPSDAE-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 39905M |
Solvent | Polysol |