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Pimelic acid, pentafluorophenyl hexadecyl ester
SpectraBase Compound ID 50ZbnTeHZHR
InChI InChI=1S/C29H43F5O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-37-22(35)19-16-15-17-20-23(36)38-29-27(33)25(31)24(30)26(32)28(29)34/h2-21H2,1H3
InChIKey FEWMIJIGFNOPNX-UHFFFAOYSA-N
Mol Weight 550.7 g/mol
Molecular Formula C29H43F5O4
Exact Mass 550.308151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1PizWSyXTVP
Name Pimelic acid, pentafluorophenyl hexadecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H43F5O4
InChI InChI=1S/C29H43F5O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-21-37-22(35)19-16-15-17-20-23(36)38-29-27(33)25(31)24(30)26(32)28(29)34/h2-21H2,1H3
InChIKey FEWMIJIGFNOPNX-UHFFFAOYSA-N
Molecular Weight 550.651 g/mol
SMILES C(CCCCCC(Oc1c(c(c(c(c1F)F)F)F)F)=O)(OCCCCCCCCCCCCCCCC)=O
SPLASH splash10-052f-9500000000-4c022ba9421a79707250
Source of Spectrum TIPS-2022-400-0
Wiley ID 1821917