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(2,6-ditert-butyl-4-methyl-phenyl) 1-[hydroxy(phenyl)methyl]-2-methyl-cyclopropanecarboxylate
SpectraBase Compound ID LSsbwBCGCsR
InChI InChI=1S/C27H36O3/c1-17-14-20(25(3,4)5)22(21(15-17)26(6,7)8)30-24(29)27(16-18(27)2)23(28)19-12-10-9-11-13-19/h9-15,18,23,28H,16H2,1-8H3
InChIKey XGFUJJDPVIMPAE-UHFFFAOYSA-N
Mol Weight 408.6 g/mol
Molecular Formula C27H36O3
Exact Mass 408.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoXEKekwGRS
Name (2,6-ditert-butyl-4-methyl-phenyl) 1-[hydroxy(phenyl)methyl]-2-methyl-cyclopropanecarboxylate
Alternate Name(s) (2,6-ditert-butyl-4-methyl-phenyl) 2-methyl-1-[oxidanyl(phenyl)methyl]cyclopropane-1-carboxylate (2,6-ditert-butyl-4-methylphenyl) 1-[hydroxy(phenyl)methyl]-2-methylcyclopropane-1-carboxylate 1-(Hydroxy-phenyl-methyl)-2-methyl-cyclopropanecarboxylic acid, 2,6-di-t-butyl-4-methyl-phenyl ester 1-[hydroxy(phenyl)methyl]-2-methyl-1-cyclopropanecarboxylic acid (2,6-ditert-butyl-4-methylphenyl) ester 1-[hydroxy(phenyl)methyl]-2-methyl-cyclopropanecarboxylic acid (2,6-ditert-butyl-4-methyl-phenyl) ester
CAS Registry Number 108546-86-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36O3
InChI InChI=1S/C27H36O3/c1-17-14-20(25(3,4)5)22(21(15-17)26(6,7)8)30-24(29)27(16-18(27)2)23(28)19-12-10-9-11-13-19/h9-15,18,23,28H,16H2,1-8H3
InChIKey XGFUJJDPVIMPAE-UHFFFAOYSA-N
Molecular Weight 408.582 g/mol
SMILES OC(C1(C(Oc2c(C(C)(C)C)cc(C)cc2C(C)(C)C)=O)CC1C)c1ccccc1
SPLASH splash10-05fr-6890000000-29e9dd0d5e1c9e194c8c
Wiley ID 1482785