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Pimelic acid, 4-methoxy-2-methylbutyl octyl ester
SpectraBase Compound ID 2Ejfwe0u8Kn
InChI InChI=1S/C21H40O5/c1-4-5-6-7-8-12-16-25-20(22)13-10-9-11-14-21(23)26-18-19(2)15-17-24-3/h19H,4-18H2,1-3H3
InChIKey GZQKWNMKDUTCNJ-UHFFFAOYSA-N
Mol Weight 372.5 g/mol
Molecular Formula C21H40O5
Exact Mass 372.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1TitZ91pWmK
Name Pimelic acid, 4-methoxy-2-methylbutyl octyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O5
InChI InChI=1S/C21H40O5/c1-4-5-6-7-8-12-16-25-20(22)13-10-9-11-14-21(23)26-18-19(2)15-17-24-3/h19H,4-18H2,1-3H3
InChIKey GZQKWNMKDUTCNJ-UHFFFAOYSA-N
Molecular Weight 372.546 g/mol
SMILES C(CCCCCC(OCC(CCOC)C)=O)(OCCCCCCCC)=O
SPLASH splash10-0udi-9600000000-038e49a2441df77f9310
Source of Spectrum TIPS-2022-787-0
Wiley ID 1822304