John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=1Bo28RTzON3 SpectraBase Spectrum ID=2vXQG7Yc7Hp

(accessed ).
1-METHYL-3-(alpha,alpha,alpha-TRIFLUORO-o-TOLYL)UREA
SpectraBase Compound ID 1Bo28RTzON3
InChI InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-5-3-2-4-6(7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)
InChIKey PMKIUKNSMDJUSB-UHFFFAOYSA-N
Mol Weight 218.18 g/mol
Molecular Formula C9H9F3N2O
Exact Mass 218.066698 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2vXQG7Yc7Hp
Name 1-METHYL-3-(alpha,alpha,alpha-TRIFLUORO-o-TOLYL)UREA
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1991-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9F3N2O
InChI InChI=1S/C9H9F3N2O/c1-13-8(15)14-7-5-3-2-4-6(7)9(10,11)12/h2-5H,1H3,(H2,13,14,15)
InChIKey PMKIUKNSMDJUSB-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Molecular Weight 218.18
Solvent DMSO-d6; Reference=TMS; Temperature 297K
SpectraBase Batch ID KLneJxsAuLa