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Pimelic acid, 2,4-dimethylpent-3-yl 4-methylpent-2-yl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, 2,4-dimethylpent-3-yl 4-methylpent-2-yl ester
SpectraBase Compound ID 5GUybwrmUgV
InChI InChI=1S/C20H38O4/c1-14(2)13-17(7)23-18(21)11-9-8-10-12-19(22)24-20(15(3)4)16(5)6/h14-17,20H,8-13H2,1-7H3
InChIKey TZIKMANZJMBTDE-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C20H38O4
Exact Mass 342.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F51W8EXnm5z
Name Pimelic acid, 2,4-dimethylpent-3-yl 4-methylpent-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O4
InChI InChI=1S/C20H38O4/c1-14(2)13-17(7)23-18(21)11-9-8-10-12-19(22)24-20(15(3)4)16(5)6/h14-17,20H,8-13H2,1-7H3
InChIKey TZIKMANZJMBTDE-UHFFFAOYSA-N
Molecular Weight 342.520 g/mol
SMILES C(CCCCCC(OC(C(C)C)C(C)C)=O)(OC(CC(C)C)C)=O
SPLASH splash10-0006-8900000000-2c5f625b8884b0ac42b9
Source of Spectrum TIPS-2022-854-0
Wiley ID 1822371