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2-Phenyl-5-(tetrazol-5-yl)-1,3,4-thiadiazole
SpectraBase Compound ID 5FLlyX0m6Bz
InChI InChI=1S/C9H6N6S/c1-2-4-6(5-3-1)8-12-13-9(16-8)7-10-14-15-11-7/h1-5H,(H,10,11,14,15)
InChIKey RBKGYRLDONAQIX-UHFFFAOYSA-N
Mol Weight 230.25 g/mol
Molecular Formula C9H6N6S
Exact Mass 230.037465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4aLGoS3vSiI
Name 2-Phenyl-5-(tetrazol-5-yl)-1,3,4-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N6S
InChI InChI=1S/C9H6N6S/c1-2-4-6(5-3-1)8-12-13-9(16-8)7-10-14-15-11-7/h1-5H,(H,10,11,14,15)
InChIKey RBKGYRLDONAQIX-UHFFFAOYSA-N
Molecular Weight 230.249 g/mol
SMILES [nH]1c(nnn1)-c1sc(nn1)-c1ccccc1
SPLASH splash10-0umr-2920000000-b6e393763bda33c94c43
Source of Spectrum K-2002-1546-10
Synonyms 5-(5-phenyl-1,3,4-thiadiazol-2-yl)-1H-tetraazole
Wiley ID 1612842