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Pimelic acid, 4-biphenyl butyl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, 4-biphenyl butyl ester
SpectraBase Compound ID 9Yp7bMBRxhc
InChI InChI=1S/C23H28O4/c1-2-3-18-26-22(24)12-8-5-9-13-23(25)27-21-16-14-20(15-17-21)19-10-6-4-7-11-19/h4,6-7,10-11,14-17H,2-3,5,8-9,12-13,18H2,1H3
InChIKey HONDLRNHDFJQEQ-UHFFFAOYSA-N
Mol Weight 368.47 g/mol
Molecular Formula C23H28O4
Exact Mass 368.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HGwQnkt16b0
Name Pimelic acid, 4-biphenyl butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H28O4
InChI InChI=1S/C23H28O4/c1-2-3-18-26-22(24)12-8-5-9-13-23(25)27-21-16-14-20(15-17-21)19-10-6-4-7-11-19/h4,6-7,10-11,14-17H,2-3,5,8-9,12-13,18H2,1H3
InChIKey HONDLRNHDFJQEQ-UHFFFAOYSA-N
Molecular Weight 368.473 g/mol
SMILES C(CCCCCC(Oc1ccc(cc1)-c1ccccc1)=O)(OCCCC)=O
SPLASH splash10-00di-1900000000-29ea1d5cfa8d7dc8b891
Source of Spectrum TIPS-2022-556-0
Wiley ID 1822073