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Pimelic acid, diphenylmethyl heptyl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, diphenylmethyl heptyl ester
SpectraBase Compound ID EZISMdydl0u
InChI InChI=1S/C27H36O4/c1-2-3-4-5-15-22-30-25(28)20-13-8-14-21-26(29)31-27(23-16-9-6-10-17-23)24-18-11-7-12-19-24/h6-7,9-12,16-19,27H,2-5,8,13-15,20-22H2,1H3
InChIKey ZAQDJKPPLXHIJW-UHFFFAOYSA-N
Mol Weight 424.6 g/mol
Molecular Formula C27H36O4
Exact Mass 424.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Yh4WWSQMBD
Name Pimelic acid, diphenylmethyl heptyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36O4
InChI InChI=1S/C27H36O4/c1-2-3-4-5-15-22-30-25(28)20-13-8-14-21-26(29)31-27(23-16-9-6-10-17-23)24-18-11-7-12-19-24/h6-7,9-12,16-19,27H,2-5,8,13-15,20-22H2,1H3
InChIKey ZAQDJKPPLXHIJW-UHFFFAOYSA-N
Molecular Weight 424.581 g/mol
SMILES C(CCCCCC(OC(c1ccccc1)c1ccccc1)=O)(OCCCCCCC)=O
SPLASH splash10-0159-1900000000-e039aff55226b8590a51
Source of Spectrum TIPS-2022-690-0
Wiley ID 1822207