SpectraBase Compound ID | JrdSgyoQ6oI |
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InChI | InChI=1S/C29H33N3O11S2/c1-15(33)39-14-24-25(40-16(2)34)26(41-17(3)35)27(42-18(4)36)28(43-24)45-21-9-7-20(8-10-21)31-29(44)32-30-13-19-6-11-22(37)23(12-19)38-5/h6-13,24-28,37H,14H2,1-5H3,(H2,31,32,44)/t24-,25-,26+,27-,28+/m1/s1 |
InChIKey | RZZWAPQKOWVPDE-DFLSAPQXSA-N |
Mol Weight | 663.7 g/mol |
Molecular Formula | C29H33N3O11S2 |
Exact Mass | 663.155651 g/mol |
SpectraBase Spectrum ID | 5HY2QkkTN6T |
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Name | vanillin, 4-[p-(beta-D-glucosylthio)phenyl]-3-thiosemicarbazone, tetraacetate |
Conditions | Basic |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C29H33N3O11S2 |
InChI | InChI=1S/C29H33N3O11S2/c1-15(33)39-14-24-25(40-16(2)34)26(41-17(3)35)27(42-18(4)36)28(43-24)45-21-9-7-20(8-10-21)31-29(44)32-30-13-19-6-11-22(37)23(12-19)38-5/h6-13,24-28,37H,14H2,1-5H3,(H2,31,32,44)/t24-,25-,26+,27-,28+/m1/s1 |
InChIKey | RZZWAPQKOWVPDE-DFLSAPQXSA-N |
Sadtler IR Number | 29762 |
Sadtler UV Number | 12358B |
Solvent | Methanol |