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Pimelic acid, dec-2-yl dodecyl ester
SpectraBase Compound ID LPZlydSIXTn
InChI InChI=1S/C29H56O4/c1-4-6-8-10-12-13-14-15-17-22-26-32-28(30)24-20-18-21-25-29(31)33-27(3)23-19-16-11-9-7-5-2/h27H,4-26H2,1-3H3
InChIKey WQTLGOAKAQKFPS-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 L2EGcnoOFOy
Name Pimelic acid, dec-2-yl dodecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H56O4
InChI InChI=1S/C29H56O4/c1-4-6-8-10-12-13-14-15-17-22-26-32-28(30)24-20-18-21-25-29(31)33-27(3)23-19-16-11-9-7-5-2/h27H,4-26H2,1-3H3
InChIKey WQTLGOAKAQKFPS-UHFFFAOYSA-N
Molecular Weight 468.763 g/mol
SMILES C(CCCCCC(OC(CCCCCCCC)C)=O)(OCCCCCCCCCCCC)=O
SPLASH splash10-0006-6900000000-6a56a360c4d456e90cbc
Source of Spectrum TIPS-2022-932-0
Wiley ID 1822449