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6-Hepten-3-one, 7-[4-(1,1-dimethylethyl)phenyl]-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-

View entire compound with spectra: 1 FTIR

6-Hepten-3-one, 7-[4-(1,1-dimethylethyl)phenyl]-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-
SpectraBase Compound ID FFc0RywCyvm
InChI InChI=1S/C21H29N3O/c1-20(2,3)17-12-10-16(11-13-17)8-7-9-18(19(25)21(4,5)6)24-15-22-14-23-24/h7-8,10-15,18H,9H2,1-6H3/b8-7+
InChIKey PCSNWLOTULLGSV-BQYQJAHWSA-N
Mol Weight 339.48 g/mol
Molecular Formula C21H29N3O
Exact Mass 339.231063 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KTUhq6vI8d0
Name 6-Hepten-3-one, 7-[4-(1,1-dimethylethyl)phenyl]-2,2-dimethyl-4-(1H-1,2,4-triazol-1-yl)-
CAS Registry Number 105708-20-1
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H29N3O
InChI InChI=1S/C21H29N3O/c1-20(2,3)17-12-10-16(11-13-17)8-7-9-18(19(25)21(4,5)6)24-15-22-14-23-24/h7-8,10-15,18H,9H2,1-6H3/b8-7+
InChIKey PCSNWLOTULLGSV-BQYQJAHWSA-N
Instrument Name Bruker IFS 85
Purity slightly contaminated
Technique Film