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Pimelic acid, 4-methoxy-2-methylbutyl tetradecyl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, 4-methoxy-2-methylbutyl tetradecyl ester
SpectraBase Compound ID 2GHaAyedLQe
InChI InChI=1S/C27H52O5/c1-4-5-6-7-8-9-10-11-12-13-14-18-22-31-26(28)19-16-15-17-20-27(29)32-24-25(2)21-23-30-3/h25H,4-24H2,1-3H3
InChIKey JWOHPQJHTHSVKY-UHFFFAOYSA-N
Mol Weight 456.7 g/mol
Molecular Formula C27H52O5
Exact Mass 456.381475 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgfYCW9ux29
Name Pimelic acid, 4-methoxy-2-methylbutyl tetradecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H52O5
InChI InChI=1S/C27H52O5/c1-4-5-6-7-8-9-10-11-12-13-14-18-22-31-26(28)19-16-15-17-20-27(29)32-24-25(2)21-23-30-3/h25H,4-24H2,1-3H3
InChIKey JWOHPQJHTHSVKY-UHFFFAOYSA-N
Molecular Weight 456.708 g/mol
SMILES C(CCCCCC(OCC(CCOC)C)=O)(OCCCCCCCCCCCCCC)=O
SPLASH splash10-0udi-9800000000-1c4edbd329663086fbfd
Source of Spectrum TIPS-2022-793-0
Wiley ID 1822310