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1,1,1-Trifluoro-4-[7'-methyl-2'-(trifluoromethyl)-6',7'-dihydro-5H-[1]-benzopyran-8'-yl]-but-3-en-2-one
SpectraBase Compound ID 6qi3T9SrnV3
InChI InChI=1S/C15H12F6O2/c1-8-2-3-9-4-7-12(15(19,20)21)23-13(9)10(8)5-6-11(22)14(16,17)18/h4-8H,2-3H2,1H3/b6-5+
InChIKey YUTIACAGSKGZSI-AATRIKPKSA-N
Mol Weight 338.25 g/mol
Molecular Formula C15H12F6O2
Exact Mass 338.074149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID TUDQ1Og8tc
Name 1,1,1-Trifluoro-4-[7'-methyl-2'-(trifluoromethyl)-6',7'-dihydro-5H-[1]-benzopyran-8'-yl]-but-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12F6O2
InChI InChI=1S/C15H12F6O2/c1-8-2-3-9-4-7-12(15(19,20)21)23-13(9)10(8)5-6-11(22)14(16,17)18/h4-8H,2-3H2,1H3/b6-5+
InChIKey YUTIACAGSKGZSI-AATRIKPKSA-N
Molecular Weight 338.249 g/mol
SMILES C=12OC(C(F)(F)F)=CC=C2CCC(C1\C=C\C(C(F)(F)F)=O)C
SPLASH splash10-014i-0093000000-d800c334c3ecfaadefdb
Source of Spectrum D1-2006-1346-3
Synonyms (3E)-1,1,1-trifluoro-4-[7-methyl-2-(trifluoromethyl)-6,7-dihydro-5H-chromen-8-yl]-3-buten-2-one (E)-1,1,1-trifluoro-4-[7-methyl-2-(trifluoromethyl)-6,7-dihydro-5H-1-benzopyran-8-yl]-3-buten-2-one (E)-1,1,1-tris(fluoranyl)-4-[7-methyl-2-(trifluoromethyl)-6,7-dihydro-5H-chromen-8-yl]but-3-en-2-one
Wiley ID 1614047