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Pimelic acid, 4-methoxy-2-methylbutyl decyl ester
SpectraBase Compound ID BEX2pDsNhtG
InChI InChI=1S/C23H44O5/c1-4-5-6-7-8-9-10-14-18-27-22(24)15-12-11-13-16-23(25)28-20-21(2)17-19-26-3/h21H,4-20H2,1-3H3
InChIKey WEBXQJNWKZVUGC-UHFFFAOYSA-N
Mol Weight 400.6 g/mol
Molecular Formula C23H44O5
Exact Mass 400.318875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6zw5xdnGY50
Name Pimelic acid, 4-methoxy-2-methylbutyl decyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H44O5
InChI InChI=1S/C23H44O5/c1-4-5-6-7-8-9-10-14-18-27-22(24)15-12-11-13-16-23(25)28-20-21(2)17-19-26-3/h21H,4-20H2,1-3H3
InChIKey WEBXQJNWKZVUGC-UHFFFAOYSA-N
Molecular Weight 400.600 g/mol
SMILES C(CCCCCC(OCC(CCOC)C)=O)(OCCCCCCCCCC)=O
SPLASH splash10-0udi-9700000000-1511bca2761c945e31c7
Source of Spectrum TIPS-2022-789-0
Wiley ID 1822306