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Pimelic acid, pentafluorophenyl tridecyl ester
SpectraBase Compound ID BCNsyYhCVgU
InChI InChI=1S/C26H37F5O4/c1-2-3-4-5-6-7-8-9-10-11-15-18-34-19(32)16-13-12-14-17-20(33)35-26-24(30)22(28)21(27)23(29)25(26)31/h2-18H2,1H3
InChIKey OPCHXFZHDIEITB-UHFFFAOYSA-N
Mol Weight 508.6 g/mol
Molecular Formula C26H37F5O4
Exact Mass 508.2612 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JY0EPOkGTwk
Name Pimelic acid, pentafluorophenyl tridecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H37F5O4
InChI InChI=1S/C26H37F5O4/c1-2-3-4-5-6-7-8-9-10-11-15-18-34-19(32)16-13-12-14-17-20(33)35-26-24(30)22(28)21(27)23(29)25(26)31/h2-18H2,1H3
InChIKey OPCHXFZHDIEITB-UHFFFAOYSA-N
Molecular Weight 508.570 g/mol
SMILES C(CCCCCC(Oc1c(c(c(c(c1F)F)F)F)F)=O)(OCCCCCCCCCCCCC)=O
SPLASH splash10-054o-9501000000-69a9e93e8b38e4da523d
Source of Spectrum TIPS-2022-397-0
Wiley ID 1821914