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1-Methyl-5-((1-phenyl-1H-tetrazol-5-yl)thio)-1H-indole
SpectraBase Compound ID JBuVVFkNE4G
InChI InChI=1S/C16H13N5S/c1-20-10-9-12-11-14(7-8-15(12)20)22-16-17-18-19-21(16)13-5-3-2-4-6-13/h2-11H,1H3
InChIKey CGSBLFAHMHOVPV-UHFFFAOYSA-N
Mol Weight 307.38 g/mol
Molecular Formula C16H13N5S
Exact Mass 307.089167 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 81iXGL0ceu6
Name 1-Methyl-5-((1-phenyl-1H-tetrazol-5-yl)thio)-1H-indole
Appearance White powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13N5S
InChI InChI=1S/C16H13N5S/c1-20-10-9-12-11-14(7-8-15(12)20)22-16-17-18-19-21(16)13-5-3-2-4-6-13/h2-11H,1H3
InChIKey CGSBLFAHMHOVPV-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201806261
Molecular Weight 307.375 g/mol
Reported Formula C16H13N5S
SMILES C[n]1ccc2c1ccc(c2)Sc1nnn[n]1-c1ccccc1
SPLASH splash10-03di-0900000000-9990fd20ee179cdff00f
Source of Spectrum QE-25-SM39-1z
Wiley ID 1848460