SpectraBase Compound ID | 61TTnGerC0C |
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InChI | InChI=1S/C13H18N2O5S2/c14-13(21)15-6-3-1-2-4-8(6)22-12-11(19)10(18)9(17)7(5-16)20-12/h1-4,7,9-12,16-19H,5H2,(H3,14,15,21)/t7-,9-,10+,11-,12+/m1/s1 |
InChIKey | ZVSBMWVSOFTUKT-URYVQPGZSA-N |
Mol Weight | 346.42 g/mol |
Molecular Formula | C13H18N2O5S2 |
Exact Mass | 346.065714 g/mol |
SpectraBase Spectrum ID | Gv7bDHps3F6 |
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Name | 1-[o-(beta-D-glucosylthio)phenyl]-2-thiourea |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H18N2O5S2 |
InChI | InChI=1S/C13H18N2O5S2/c14-13(21)15-6-3-1-2-4-8(6)22-12-11(19)10(18)9(17)7(5-16)20-12/h1-4,7,9-12,16-19H,5H2,(H3,14,15,21)/t7-,9-,10+,11-,12+/m1/s1 |
InChIKey | ZVSBMWVSOFTUKT-URYVQPGZSA-N |
Sadtler IR Number | 29773 |
Sadtler UV Number | 12366N |
Solvent | Methanol |