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4-Butylbenzoic acid, 3-pentadecyl ester
SpectraBase Compound ID HQjMs5MKkh0
InChI InChI=1S/C26H44O2/c1-4-7-9-10-11-12-13-14-15-16-18-25(6-3)28-26(27)24-21-19-23(20-22-24)17-8-5-2/h19-22,25H,4-18H2,1-3H3
InChIKey AVNOFVVLPCGKLL-UHFFFAOYSA-N
Mol Weight 388.6 g/mol
Molecular Formula C26H44O2
Exact Mass 388.334131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vibD7Euxs
Name 4-Butylbenzoic acid, 3-pentadecyl ester
Alternate Name(s) 4-Butylbenzoic acid pentadecan-3-yl ester 1-Ethyltridecyl 4-butylbenzoate Pentadecan-3-yl 4-butylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H44O2
InChI InChI=1S/C26H44O2/c1-4-7-9-10-11-12-13-14-15-16-18-25(6-3)28-26(27)24-21-19-23(20-22-24)17-8-5-2/h19-22,25H,4-18H2,1-3H3
InChIKey AVNOFVVLPCGKLL-UHFFFAOYSA-N
Molecular Weight 388.636 g/mol
SMILES c1(ccc(cc1)C(OC(CCCCCCCCCCCC)CC)=O)CCCC
SPLASH splash10-03fr-4900000000-fae3a3475ed971540e3b
Source of Spectrum NP-14-1628-0
Wiley ID 1111567