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4-[p-(beta-D-glucosylthio)phenyl]-3-thiosemicarbazide

View entire compound with spectra: 1 FTIR, and 3 UV-Vis

4-[p-(beta-D-glucosylthio)phenyl]-3-thiosemicarbazide
SpectraBase Compound ID GIO6ktVGxgT
InChI InChI=1S/C13H19N3O5S2/c14-16-13(22)15-6-1-3-7(4-2-6)23-12-11(20)10(19)9(18)8(5-17)21-12/h1-4,8-12,17-20H,5,14H2,(H2,15,16,22)/t8-,9-,10+,11-,12+/m1/s1
InChIKey NGRRJVODCMPNDA-ZIQFBCGOSA-N
Mol Weight 361.43 g/mol
Molecular Formula C13H19N3O5S2
Exact Mass 361.076613 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5yFx7E1lOHD
Name 4-[p-(beta-D-GLUCOSYLTHIO)PHENYL]-3-THIOSEMICARBAZIDE
Source of Sample G. Wagner, Karl-Marx University, Leipzig, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19N3O5S2
InChI InChI=1S/C13H19N3O5S2/c14-16-13(22)15-6-1-3-7(4-2-6)23-12-11(20)10(19)9(18)8(5-17)21-12/h1-4,8-12,17-20H,5,14H2,(H2,15,16,22)/t8-,9-,10+,11-,12+/m1/s1
InChIKey NGRRJVODCMPNDA-ZIQFBCGOSA-N
Literature Reference Abstract-Chemical Abstracts= 60, 4239(1964)
Melting Point 165-168C
Molecular Weight 361.431000
Optical Properties Optical Rotation= (20C) -40.6 DEG (c=1.0, METHANOL)
Synonyms SEMICARBAZIDE, 4-/P-/B-D-GLUCOSYL- THIO/PHENYL/-3-THIO-, /MINUS/-, SEMICARBAZIDE, 4-/P-/B-D-GLUCO- PYRANOSYLTHIO/PHENYL/-3-THIO-, /MINUS/-, GLUCOPYRANOSIDE, /P-/3-AMINO-2- THIOUREIDO/PHENYL/ 1-THIO-, B-D- /MINUS/-,
Technique KBr WAFER