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2-(2,4-Dihydroxyphenyl)-5-(3-hydroxypropyl)-1,3,4-thidiazole
SpectraBase Compound ID 5R6fmXEevsS
InChI InChI=1S/C11H12N2O3S/c14-5-1-2-10-12-13-11(17-10)8-4-3-7(15)6-9(8)16/h3-4,6,14-16H,1-2,5H2
InChIKey QBBZPXLKUYDNSI-UHFFFAOYSA-N
Mol Weight 252.29 g/mol
Molecular Formula C11H12N2O3S
Exact Mass 252.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmbJtOp5WFS
Name 2-(2,4-Dihydroxyphenyl)-5-(3-hydroxypropyl)-1,3,4-thidiazole
Alternate Name(s) 4-(5-(3-hydroxypropyl)-1,3,4-thiadiazol-2-yl)benzene-1,3-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2O3S
InChI InChI=1S/C11H12N2O3S/c14-5-1-2-10-12-13-11(17-10)8-4-3-7(15)6-9(8)16/h3-4,6,14-16H,1-2,5H2
InChIKey QBBZPXLKUYDNSI-UHFFFAOYSA-N
Molecular Weight 252.288 g/mol
SMILES OCCCc1nnc(-c2c(cc(cc2)O)O)s1
SPLASH splash10-0a4i-1290000000-f2cb159d50b9ed14cf34
Source of Spectrum EMC-41-478-5
Wiley ID 1734993