benzaldehyde, 4-[p-(beta-D-glucosylthio)phenyl]-3-thiosemicarbazone

SpectraBase Compound ID	4tdVsq1eiLm
InChI	InChI=1S/C20H23N3O5S2/c24-11-15-16(25)17(26)18(27)19(28-15)30-14-8-6-13(7-9-14)22-20(29)23-21-10-12-4-2-1-3-5-12/h1-10,15-19,24-27H,11H2,(H2,22,23,29)/t15-,16-,17+,18-,19+/m1/s1
InChIKey	CPTWWPDUNUNLFF-FQBWVUSXSA-N Google Search
Mol Weight	449.54 g/mol
Molecular Formula	C20H23N3O5S2
Exact Mass	449.107913 g/mol

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SpectraBase Spectrum ID	E0xDqxv17Zf
Name	BENZALDEHYDE, 4-[p-(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/c24-11-15-16(25)17(26)18(27)19(28-15)30-14-8-6-13(7-9-14)22-20(29)23-21-10-12-4-2-1-3-5-12/h1-10,15-19,24-27H,11H2,(H2,22,23,29)/t15-,16-,17+,18-,19+/m1/s1
InChIKey	CPTWWPDUNUNLFF-FQBWVUSXSA-N
Literature Reference	Abstract-Chemical Abstracts= 60, 4239(1964)
Melting Point	150-153C
Molecular Weight	449.540009
Optical Properties	Optical Rotation= (20C) -28.5 DEG (c=2.0, DMF)
Synonyms	BENZALDEHYDE, 4-/P-/B-D-GLUCOSYL- THIO/PHENYL/-3-THIOSEMICARBAZONE, /MINUS/-, GLUCOPYRANOSIDE, /P-/3-/BENZYL- IDENEAMINO/-2-THIOUREIDO/PHENYL/ 1- THIO-, B-D-/MINUS/-, BENZALDEHYDE, 4-/P-/B-D-GLUCOPYRAN- OSYLTHIO/PHENYL/-3-THIOSEMICARBAZONE, /MINUS/-,
Technique	KBr WAFER