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Pimelic acid, 3-fluorophenyl decyl ester
SpectraBase Compound ID 2Vh3QBWQ389
InChI InChI=1S/C23H35FO4/c1-2-3-4-5-6-7-8-12-18-27-22(25)16-10-9-11-17-23(26)28-21-15-13-14-20(24)19-21/h13-15,19H,2-12,16-18H2,1H3
InChIKey BQWDYGMSBFBJJN-UHFFFAOYSA-N
Mol Weight 394.5 g/mol
Molecular Formula C23H35FO4
Exact Mass 394.251938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YtvXxGG8
Name Pimelic acid, 3-fluorophenyl decyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35FO4
InChI InChI=1S/C23H35FO4/c1-2-3-4-5-6-7-8-12-18-27-22(25)16-10-9-11-17-23(26)28-21-15-13-14-20(24)19-21/h13-15,19H,2-12,16-18H2,1H3
InChIKey BQWDYGMSBFBJJN-UHFFFAOYSA-N
Molecular Weight 394.527 g/mol
SMILES C(CCCCCC(Oc1cccc(c1)F)=O)(OCCCCCCCCCC)=O
SPLASH splash10-054o-9610000000-3c48f10191ebe680fc8c
Source of Spectrum TIPS-2022-384-0
Wiley ID 1821901