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4,5-Dihydro-5,5-dimethyl-1,3-diphenyl-1H-[4-(15)N]-1,2,4-triazole
SpectraBase Compound ID 6JxEfIk1hpH
InChI InChI=1S/C16H17N3/c1-16(2)17-15(13-9-5-3-6-10-13)18-19(16)14-11-7-4-8-12-14/h3-12H,1-2H3,(H,17,18)/i17+1
InChIKey ATSJJLVDZRWZPS-CAAGJAQSSA-N
Mol Weight 252.33 g/mol
Molecular Formula C16H17N215N
Exact Mass 252.139282 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GyojLWTfSOU
Name 4,5-Dihydro-5,5-dimethyl-1,3-diphenyl-1H-[4-(15)N]-1,2,4-triazole
Comments Original formula: C16H17N2[15N]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N3
InChI InChI=1S/C16H17N3/c1-16(2)17-15(13-9-5-3-6-10-13)18-19(16)14-11-7-4-8-12-14/h3-12H,1-2H3,(H,17,18)/i17+1
InChIKey ATSJJLVDZRWZPS-CAAGJAQSSA-N
Molecular Weight 252.326 g/mol
SMILES N1N(C([15N]=C1c1ccccc1)(C)C)c1ccccc1
SPLASH splash10-000i-1090000000-d6a7dfc7e96c3e69290c
Source of Spectrum F-51-12893-5
Wiley ID 794434