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10-(heptafluoropropyl)-2,3,6,7-tetrahydro-9-methyl-1H,5H,11H-pyrano[2',3' -4,5]benzo[1,2,3-ij]quinolizin-11-one
SpectraBase Compound ID C5oScPNtWSR
InChI InChI=1S/C19H16F7NO2/c1-9-12-8-10-4-2-6-27-7-3-5-11(14(10)27)15(12)29-16(28)13(9)17(20,21)18(22,23)19(24,25)26/h8H,2-7H2,1H3
InChIKey YBJDXDHZCTUVDV-UHFFFAOYSA-N
Mol Weight 423.33 g/mol
Molecular Formula C19H16F7NO2
Exact Mass 423.106926 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CyckhYlLCLh
Name 10-(heptafluoropropyl)-2,3,6,7-tetrahydro-9-methyl-1H,5H,11H-pyrano[2',3' -4,5]benzo[1,2,3-ij]quinolizin-11-one
CAS Registry Number 137516-25-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16F7NO2
InChI InChI=1S/C19H16F7NO2/c1-9-12-8-10-4-2-6-27-7-3-5-11(14(10)27)15(12)29-16(28)13(9)17(20,21)18(22,23)19(24,25)26/h8H,2-7H2,1H3
InChIKey YBJDXDHZCTUVDV-UHFFFAOYSA-N
Molecular Weight 423.331 g/mol
SMILES C1(C(C(C(F)(F)F)(F)F)(F)F)=C(c2cc3CCCN4c3c(c2OC1=O)CCC4)C
SPLASH splash10-00e9-8000900000-af4d0115f264087ae292
Source of Spectrum K-125-470-2
Synonyms 10-(1,1,2,2,3,3,3-heptafluoropropyl)-9-methyl-2,3,6,7-tetrahydro-1H,5H,11H-pyrano[2,3-f]pyrido[3,2,1-ij]quinolin-11-one
Wiley ID 1378891