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4-(2,4-dineopentylphenoxy)butyric acid

View entire compound with spectra: 1 MS (GC)

4-(2,4-dineopentylphenoxy)butyric acid
SpectraBase Compound ID 5Kx33881dCV
InChI InChI=1S/C20H32O3/c1-19(2,3)13-15-9-10-17(23-11-7-8-18(21)22)16(12-15)14-20(4,5)6/h9-10,12H,7-8,11,13-14H2,1-6H3,(H,21,22)
InChIKey IIUKMJRZSNCGJK-UHFFFAOYSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCf2O5v0fXm
Name 4-(2,4-dineopentylphenoxy)butyric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-19(2,3)13-15-9-10-17(23-11-7-8-18(21)22)16(12-15)14-20(4,5)6/h9-10,12H,7-8,11,13-14H2,1-6H3,(H,21,22)
InChIKey IIUKMJRZSNCGJK-UHFFFAOYSA-N
Molecular Weight 320.473 g/mol
SMILES OC(CCCOc1c(CC(C)(C)C)cc(CC(C)(C)C)cc1)=O
SPLASH splash10-052f-9330000000-ffe023d01f11dede3298
Synonyms 4-[2,4-bis(2,2-dimethylpropyl)phenoxy]butanoic acid
Wiley ID 1444058