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1-(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3,4,4,4-heptafluoro-1-butanone
SpectraBase Compound ID I4sU53qqv2d
InChI InChI=1S/C13H10F7NO/c14-11(15,12(16,17)13(18,19)20)10(22)21-6-5-8-3-1-2-4-9(8)7-21/h1-4H,5-7H2
InChIKey ATDZARNXGLLMPI-UHFFFAOYSA-N
Mol Weight 329.22 g/mol
Molecular Formula C13H10F7NO
Exact Mass 329.065061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzY9iRJYhs0
Name 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3,4,4,4-heptafluoro-1-butanone
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Formula C13H10F7NO
InChI InChI=1S/C13H10F7NO/c14-11(15,12(16,17)13(18,19)20)10(22)21-6-5-8-3-1-2-4-9(8)7-21/h1-4H,5-7H2
InChIKey ATDZARNXGLLMPI-UHFFFAOYSA-N
Molecular Weight 329.218 g/mol
SMILES C(C(C(F)(F)F)(F)F)(C(N1Cc2ccccc2CC1)=O)(F)F
SPLASH splash10-02di-3934000000-a231edbd115b45dbddcb
Source of Spectrum JC-491-401-2
Synonyms 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3,4,4,4-heptafluoro-butan-1-one 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2,2,3,3,4,4,4-heptakis(fluoranyl)butan-1-one
Wiley ID 1326930