SpectraBase Compound ID | 7aUepIeWE9K |
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InChI | InChI=1S/C30H33N3O9S2/c1-18(34)38-17-24-26(39-19(2)35)27(40-20(3)36)28(41-21(4)37)29(42-24)44-25-15-9-8-14-23(25)32-30(43)33-31-16-10-13-22-11-6-5-7-12-22/h5-16,24,26-29H,17H2,1-4H3,(H2,32,33,43)/t24-,26-,27+,28-,29+/m1/s1 |
InChIKey | QBCLXNGZCJLVTH-RIAYOEEMSA-N |
Mol Weight | 643.7 g/mol |
Molecular Formula | C30H33N3O9S2 |
Exact Mass | 643.165822 g/mol |
SpectraBase Spectrum ID | 9mbCeTs3fO7 |
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Name | cinnamaldehyde, 4-[o-(beta-D-glucosylthio)phenyl]-3-thiosemicarbazone, tetraacetate |
Conditions | Basic |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C30H33N3O9S2 |
InChI | InChI=1S/C30H33N3O9S2/c1-18(34)38-17-24-26(39-19(2)35)27(40-20(3)36)28(41-21(4)37)29(42-24)44-25-15-9-8-14-23(25)32-30(43)33-31-16-10-13-22-11-6-5-7-12-22/h5-16,24,26-29H,17H2,1-4H3,(H2,32,33,43)/t24-,26-,27+,28-,29+/m1/s1 |
InChIKey | QBCLXNGZCJLVTH-RIAYOEEMSA-N |
Sadtler IR Number | 29763 |
Sadtler UV Number | 12359B |
Solvent | Methanol |