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4,5-Dihydro-5,5-dimethyl-1,3-diphenyl-1H-1,2,4-triazole

View entire compound with spectra: 1 MS (GC)

4,5-Dihydro-5,5-dimethyl-1,3-diphenyl-1H-1,2,4-triazole
SpectraBase Compound ID 48GSf6ZVA0r
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)
InChIKey ATSJJLVDZRWZPS-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C16H17N3
Exact Mass 251.142248 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JyOmmT9nS1R
Name 4,5-Dihydro-5,5-dimethyl-1,3-diphenyl-1H-1,2,4-triazole
Alternate Name(s) 5,5-Dimethyl-1,3-diphenyl-4,5-dihydro-1H-1,2,4-triazole
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)
InChIKey ATSJJLVDZRWZPS-UHFFFAOYSA-N
Molecular Weight 251.333 g/mol
SMILES N1C(N(N=C1c1ccccc1)c1ccccc1)(C)C
SPLASH splash10-000i-1090000000-8143d5dbe041b6bb935a
Source of Spectrum F-51-12893-5
Wiley ID 794436