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Pimelic acid, pentafluorophenyl 4-methylpent-2-yl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, pentafluorophenyl 4-methylpent-2-yl ester
SpectraBase Compound ID 5pS6z4PetRu
InChI InChI=1S/C19H23F5O4/c1-10(2)9-11(3)27-12(25)7-5-4-6-8-13(26)28-19-17(23)15(21)14(20)16(22)18(19)24/h10-11H,4-9H2,1-3H3
InChIKey PNLNDZTZUMUSTD-UHFFFAOYSA-N
Mol Weight 410.38 g/mol
Molecular Formula C19H23F5O4
Exact Mass 410.15165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KoxnScHNcEJ
Name Pimelic acid, pentafluorophenyl 4-methylpent-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23F5O4
InChI InChI=1S/C19H23F5O4/c1-10(2)9-11(3)27-12(25)7-5-4-6-8-13(26)28-19-17(23)15(21)14(20)16(22)18(19)24/h10-11H,4-9H2,1-3H3
InChIKey PNLNDZTZUMUSTD-UHFFFAOYSA-N
Molecular Weight 410.381 g/mol
SMILES C(CCCCCC(Oc1c(c(c(c(c1F)F)F)F)F)=O)(OC(CC(C)C)C)=O
SPLASH splash10-052f-9301000000-629d08b3d9d1698fc841
Source of Spectrum TIPS-2022-390-0
Wiley ID 1821907