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Pimelic acid, 5-methoxy-3-methylpentyl 4-methylpent-2-yl ester
SpectraBase Compound ID 6sYCaC4bUPY
InChI InChI=1S/C20H38O5/c1-16(2)15-18(4)25-20(22)10-8-6-7-9-19(21)24-14-12-17(3)11-13-23-5/h16-18H,6-15H2,1-5H3
InChIKey IOCKHCOJXJMARW-UHFFFAOYSA-N
Mol Weight 358.5 g/mol
Molecular Formula C20H38O5
Exact Mass 358.271924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uxP0T849oo
Name Pimelic acid, 5-methoxy-3-methylpentyl 4-methylpent-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O5
InChI InChI=1S/C20H38O5/c1-16(2)15-18(4)25-20(22)10-8-6-7-9-19(21)24-14-12-17(3)11-13-23-5/h16-18H,6-15H2,1-5H3
InChIKey IOCKHCOJXJMARW-UHFFFAOYSA-N
Molecular Weight 358.519 g/mol
SMILES C(CCCCCC(OCCC(CCOC)C)=O)(OC(CC(C)C)C)=O
SPLASH splash10-014i-9800000000-f72bcb595b48ef3d4fe4
Source of Spectrum TIPS-2022-941-0
Wiley ID 1822458