VANILLIN, 4-[o-(beta-D-GLUCOSYLTHIO)PHENYL]-3-THIOSEMICARBAZONE

SpectraBase Compound ID	1Vd99Gs31Jw
InChI	InChI=1S/C21H25N3O7S2/c1-30-14-8-11(6-7-13(14)26)9-22-24-21(32)23-12-4-2-3-5-16(12)33-20-19(29)18(28)17(27)15(10-25)31-20/h2-9,15,17-20,25-29H,10H2,1H3,(H2,23,24,32)/t15-,17-,18+,19-,20+/m1/s1
InChIKey	PQKJQGWQNRCHBI-PKOFMYQESA-N Google Search
Mol Weight	495.57 g/mol
Molecular Formula	C21H25N3O7S2
Exact Mass	495.113392 g/mol

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SpectraBase Spectrum ID	K9jcVK6N3Hr
Name	VANILLIN, 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	C21H25N3O7S2
InChI	InChI=1S/C21H25N3O7S2/c1-30-14-8-11(6-7-13(14)26)9-22-24-21(32)23-12-4-2-3-5-16(12)33-20-19(29)18(28)17(27)15(10-25)31-20/h2-9,15,17-20,25-29H,10H2,1H3,(H2,23,24,32)/t15-,17-,18+,19-,20+/m1/s1
InChIKey	PQKJQGWQNRCHBI-PKOFMYQESA-N
Literature Reference	Abstract-Chemical Abstracts= 60, 4239(1964)
Molecular Weight	495.565002
Optical Properties	Optical Rotation= (20C) 14.4 DEG (c=2.0, DMF)
Synonyms	VANILLIN, 4-/O-/B-D-GLUCOPYRANOSYL- THIO/PHENYL/-3-THIOSEMICARBAZONE, /PLUS/-, GLUCOPYRANOSIDE, /O-/3-/VANILLI- DENEAMINO/-2-THIOUREIDO/PHENYL/ 1- THIO-, B-D-/PLUS/-, VANILLIN, 4-/O-/B-D-GLUCOSYLTHIO/- PHENYL/-3-THIOSEMICARBAZONE, /PLUS/-,
Technique	KBr WAFER