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Tetradecanoyl chloride, 2-[4-(acetyloxy)-3-(1,1-dimethylethyl)phenoxy]-
SpectraBase Compound ID 850n3L3iGtr
InChI InChI=1S/C26H41ClO4/c1-6-7-8-9-10-11-12-13-14-15-16-24(25(27)29)31-21-17-18-23(30-20(2)28)22(19-21)26(3,4)5/h17-19,24H,6-16H2,1-5H3
InChIKey CIKIBKBOYUJPFA-UHFFFAOYSA-N
Mol Weight 453.1 g/mol
Molecular Formula C26H41ClO4
Exact Mass 452.269337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3SlujakMGO
Name Tetradecanoyl chloride, 2-[4-(acetyloxy)-3-(1,1-dimethylethyl)phenoxy]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H41ClO4
InChI InChI=1S/C26H41ClO4/c1-6-7-8-9-10-11-12-13-14-15-16-24(25(27)29)31-21-17-18-23(30-20(2)28)22(19-21)26(3,4)5/h17-19,24H,6-16H2,1-5H3
InChIKey CIKIBKBOYUJPFA-UHFFFAOYSA-N
Molecular Weight 453.063 g/mol
SMILES CCCCCCCCCCCCC(Oc1ccc(OC(C)=O)c(c1)C(C)(C)C)C(Cl)=O
SPLASH splash10-05p2-9503000000-d11e18216c810bda9d32
Source of Spectrum JX-2015-4-636
Synonyms 2-(tert-butyl)-4-((1-chloro-1-oxotetradecan-2-yl)oxy)phenyl acetate 2-Tert-butyl-4-[(1-chloro-1-oxotetradecan-2-yl)oxy]phenyl acetate Acetic acid [2-tert-butyl-4-(1-chloro-1-oxotetradecan-2-yl)oxyphenyl] ester [2-tert-butyl-4-(1-chloro-1-oxotetradecan-2-yl)oxyphenyl] acetate [2-tert-butyl-4-(1-chlorocarbonyltridecoxy)phenyl] acetate [2-tert-butyl-4-(1-chloranyl-1-oxidanylidene-tetradecan-2-yl)oxy-phenyl] ethanoate
Wiley ID 1726060