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4-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-keto-butyric acid

View entire compound with spectra: 1 MS (GC)

4-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-keto-butyric acid
SpectraBase Compound ID 9MsCAu6bqUS
InChI InChI=1S/C18H26O4/c1-17(2,3)12-9-11(14(19)7-8-15(20)21)10-13(16(12)22)18(4,5)6/h9-10,22H,7-8H2,1-6H3,(H,20,21)
InChIKey JEPXLXROZITDFU-UHFFFAOYSA-N
Mol Weight 306.4 g/mol
Molecular Formula C18H26O4
Exact Mass 306.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8O4t3Z9ZC7r
Name 4-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-keto-butyric acid
Alternate Name(s) 4-(3,5-ditert-butyl-4-hydroxy-phenyl)-4-oxo-butanoic acid 4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-4-oxidanylidene-butanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O4
InChI InChI=1S/C18H26O4/c1-17(2,3)12-9-11(14(19)7-8-15(20)21)10-13(16(12)22)18(4,5)6/h9-10,22H,7-8H2,1-6H3,(H,20,21)
InChIKey JEPXLXROZITDFU-UHFFFAOYSA-N
Molecular Weight 306.402 g/mol
SMILES OC(CCC(c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)=O)=O
SPLASH splash10-001i-1091000000-743311121a60bcb34a33
Source of Spectrum IC-879-0-0
Wiley ID 1308223