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3-Methoxy-5-(1-phenyl-1H-tetrazol-5-ylthio)benzene-1,2-diol
SpectraBase Compound ID IR21AtF1hAB
InChI InChI=1S/C14H12N4O3S/c1-21-12-8-10(7-11(19)13(12)20)22-14-15-16-17-18(14)9-5-3-2-4-6-9/h2-8,19-20H,1H3
InChIKey XHPLIMIYZINBOW-UHFFFAOYSA-N
Mol Weight 316.34 g/mol
Molecular Formula C14H12N4O3S
Exact Mass 316.063011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9xJL4et3row
Name 3-Methoxy-5-(1-phenyl-1H-tetrazol-5-ylthio)benzene-1,2-diol
Alternate Name(s) 3-Methoxy-5-((1-phenyl-1H-tetrazol-5-yl)thio)benzene-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N4O3S
InChI InChI=1S/C14H12N4O3S/c1-21-12-8-10(7-11(19)13(12)20)22-14-15-16-17-18(14)9-5-3-2-4-6-9/h2-8,19-20H,1H3
InChIKey XHPLIMIYZINBOW-UHFFFAOYSA-N
Literature Reference DOI 10.1248/cpb.59.1149
Molecular Weight 316.335 g/mol
SMILES Oc1c(cc(cc1O)Sc1nnn[n]1-c1ccccc1)OC
SPLASH splash10-00xr-2902000000-824070ed2ce058777c5f
Source of Spectrum E1-59-1151-2A
Wiley ID 1743711