For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,3-dimethyl-1-[5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2H-tetrazol-2-yl]-2-butanone
SpectraBase Compound ID 5E0Dhk4Gwrm
InChI InChI=1S/C14H15F3N4O/c1-13(2,3)11(22)8-21-19-12(18-20-21)9-5-4-6-10(7-9)14(15,16)17/h4-7H,8H2,1-3H3
InChIKey PQPBMRWVDBIROL-UHFFFAOYSA-N
Mol Weight 312.3 g/mol
Molecular Formula C14H15F3N4O
Exact Mass 312.119796 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2OndsZBEk2m
Name 3,3-DIMETHYL-1-[5-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-2H-TETRAZOL-2-YL]-2-BUTANONE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15F3N4O
InChI InChI=1S/C14H15F3N4O/c1-13(2,3)11(22)8-21-19-12(18-20-21)9-5-4-6-10(7-9)14(15,16)17/h4-7H,8H2,1-3H3
InChIKey PQPBMRWVDBIROL-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 67-69C
Molecular Weight 312.30
Solvent CDCl3; Reference=TMS; Temperature 297K