SpectraBase Compound ID | Dq5XIEElVEI |
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InChI | InChI=1S/C9H15N3O2S.2H2O/c1-12(2,3)7(8(13)14)4-6-5-10-9(15)11-6;;/h5,7H,4H2,1-3H3,(H2-,10,11,13,14,15);2*1H2 |
InChIKey | DMDKIJGHKUAOAK-UHFFFAOYSA-N |
Mol Weight | 265.33 g/mol |
Molecular Formula | C9H19N3O4S |
Exact Mass | 265.109627 g/mol |
SpectraBase Spectrum ID | 3hdqd1SQLH0 |
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Name | [1-carboxy-2-[2-mercaptoimidazol-4(or 5)-yl]ethyl]trimethylammonium hydroxide, inner salt, dihydrate |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H19N3O4S |
InChI | InChI=1S/C9H15N3O2S.2H2O/c1-12(2,3)7(8(13)14)4-6-5-10-9(15)11-6;;/h5,7H,4H2,1-3H3,(H2-,10,11,13,14,15);2*1H2 |
InChIKey | DMDKIJGHKUAOAK-UHFFFAOYSA-N |
Sadtler IR Number | 17439 |
Sadtler UV Number | 7338N |
Solvent | Methanol |