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Pimelic acid, 2-ethylphenyl isobutyl ester
SpectraBase Compound ID D2Ok6O4R2zF
InChI InChI=1S/C19H28O4/c1-4-16-10-8-9-11-17(16)23-19(21)13-7-5-6-12-18(20)22-14-15(2)3/h8-11,15H,4-7,12-14H2,1-3H3
InChIKey WMZRUIUZXZGMPD-UHFFFAOYSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ubdrrUVto
Name Pimelic acid, 2-ethylphenyl isobutyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-4-16-10-8-9-11-17(16)23-19(21)13-7-5-6-12-18(20)22-14-15(2)3/h8-11,15H,4-7,12-14H2,1-3H3
InChIKey WMZRUIUZXZGMPD-UHFFFAOYSA-N
Molecular Weight 320.429 g/mol
SMILES C(CCCCCC(Oc1c(cccc1)CC)=O)(OCC(C)C)=O
SPLASH splash10-0adm-7900000000-43d2cfa69e852f06bb26
Source of Spectrum TIPS-2022-424-0
Wiley ID 1821941