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7-diethylamino-3-(trifluoromethyl)-4-methylcoumarin
SpectraBase Compound ID KBAM0RI0BRI
InChI InChI=1S/C15H16F3NO2/c1-4-19(5-2)10-6-7-11-9(3)13(15(16,17)18)14(20)21-12(11)8-10/h6-8H,4-5H2,1-3H3
InChIKey MXRXVLMLCWAGKE-UHFFFAOYSA-N
Mol Weight 299.29 g/mol
Molecular Formula C15H16F3NO2
Exact Mass 299.113313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GzixrimVjd4
Name 7-diethylamino-3-(trifluoromethyl)-4-methylcoumarin
CAS Registry Number 133721-29-6
Comments Less than 3 mono-isotopic peaks
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Formula C15H16F3NO2
InChI InChI=1S/C15H16F3NO2/c1-4-19(5-2)10-6-7-11-9(3)13(15(16,17)18)14(20)21-12(11)8-10/h6-8H,4-5H2,1-3H3
InChIKey MXRXVLMLCWAGKE-UHFFFAOYSA-N
Molecular Weight 299.293 g/mol
SMILES C=1(C(Oc2c(C1C)ccc(N(CC)CC)c2)=O)C(F)(F)F
SPLASH splash10-001i-0090000000-1e7fa873eb1b58e4e360
Source of Spectrum K-125-470-2
Synonyms 7-(diethylamino)-4-methyl-3-(trifluoromethyl)-2H-chromen-2-one
Wiley ID 1301853