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1-(1-phenylcyclohexyl)-4-(heptafluoropropylcarbonyloxy)piperidine
SpectraBase Compound ID KHgzWUv3UJO
InChI InChI=1S/C21H24F7NO2/c22-19(23,20(24,25)21(26,27)28)17(30)31-16-9-13-29(14-10-16)18(11-5-2-6-12-18)15-7-3-1-4-8-15/h1,3-4,7-8,16H,2,5-6,9-14H2
InChIKey MPBWTBUOBSOBAS-UHFFFAOYSA-N
Mol Weight 455.42 g/mol
Molecular Formula C21H24F7NO2
Exact Mass 455.169526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1CgAJ1ZEW8a
Name 1-(1-phenylcyclohexyl)-4-(heptafluoropropylcarbonyloxy)piperidine
Alternate Name(s) 1-(1-phenylcyclohexyl)-4-piperidinyl 2,2,3,3,4,4,4-heptafluorobutanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24F7NO2
InChI InChI=1S/C21H24F7NO2/c22-19(23,20(24,25)21(26,27)28)17(30)31-16-9-13-29(14-10-16)18(11-5-2-6-12-18)15-7-3-1-4-8-15/h1,3-4,7-8,16H,2,5-6,9-14H2
InChIKey MPBWTBUOBSOBAS-UHFFFAOYSA-N
Molecular Weight 455.417 g/mol
SMILES C(C(C(OC1CCN(CC1)C1(c2ccccc2)CCCCC1)=O)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-08fu-4501900000-fe10cd72ac641787b0dc
Source of Spectrum CJ-1992-0-0
Wiley ID 1388993