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benzaldehyde, 4-[o-(beta-D-glucosylthio)phenyl]-3-thiosemicarbazone
SpectraBase Compound ID BUrShR6yZTd
InChI InChI=1S/C20H23N3O5S2/c24-11-14-16(25)17(26)18(27)19(28-14)30-15-9-5-4-8-13(15)22-20(29)23-21-10-12-6-2-1-3-7-12/h1-10,14,16-19,24-27H,11H2,(H2,22,23,29)/t14-,16-,17+,18-,19+/m1/s1
InChIKey AQZQLYVWRPIHPY-FTWQHDNSSA-N
Mol Weight 449.54 g/mol
Molecular Formula C20H23N3O5S2
Exact Mass 449.107913 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4Dx1D5XAxlt
Name BENZALDEHYDE, 4-[o-(beta-D-GLUCOSYLTHIO)PHENYL]-3-THIOSEMICARBAZONE
Source of Sample G. Wagner, Karl-Marx University, Leipzig, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N3O5S2
InChI InChI=1S/C20H23N3O5S2/c24-11-14-16(25)17(26)18(27)19(28-14)30-15-9-5-4-8-13(15)22-20(29)23-21-10-12-6-2-1-3-7-12/h1-10,14,16-19,24-27H,11H2,(H2,22,23,29)/t14-,16-,17+,18-,19+/m1/s1
InChIKey AQZQLYVWRPIHPY-FTWQHDNSSA-N
Literature Reference Abstract-Chemical Abstracts= 60, 4239(1964)
Melting Point 143-148C
Molecular Weight 449.540009
Optical Properties Optical Rotation= (20C) 12.6 DEG (c=1.5, DMF)
Synonyms BENZALDEHYDE, 4-/O-/B-D-GLUCOSYL- THIO/PHENYL/-3-THIOSEMICARBAZONE, /PLUS/-, BENZALDEHYDE, 4-/O-/B-D-GLUCOPYRAN- OSYLTHIO/PHENYL/-3-THIOSEMICARBAZONE, /PLUS/-, GLUCOPYRANOSIDE, /O-/3-/BENZYL- IDENEAMINO/-2-THIOUREIDO/PHENYL/ 1- THIO-, B-D-/PLUS/-,
Technique KBr WAFER