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Pimelic acid, hept-2-yl pentadecyl ester
SpectraBase Compound ID BYko5hTQ1fS
InChI InChI=1S/C29H56O4/c1-4-6-8-9-10-11-12-13-14-15-16-17-22-26-32-28(30)24-20-18-21-25-29(31)33-27(3)23-19-7-5-2/h27H,4-26H2,1-3H3
InChIKey OEQOGPSIKSFPNM-UHFFFAOYSA-N
Mol Weight 468.8 g/mol
Molecular Formula C29H56O4
Exact Mass 468.41786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7VqRqkogWEi
Name Pimelic acid, hept-2-yl pentadecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H56O4
InChI InChI=1S/C29H56O4/c1-4-6-8-9-10-11-12-13-14-15-16-17-22-26-32-28(30)24-20-18-21-25-29(31)33-27(3)23-19-7-5-2/h27H,4-26H2,1-3H3
InChIKey OEQOGPSIKSFPNM-UHFFFAOYSA-N
Molecular Weight 468.763 g/mol
SMILES C(CCCCCC(OC(CCCCC)C)=O)(OCCCCCCCCCCCCCCC)=O
SPLASH splash10-0006-7900000000-b8f13e12a9f9d2cff063
Source of Spectrum TIPS-2022-990-0
Wiley ID 1822507