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Cyclopropanecarboxylic acid, 2-phenyl-, 2,6-bis(1,1-dimethylethyl)-4-methylphenyl ester
SpectraBase Compound ID 4wPHPbT6ITM
InChI InChI=1S/C25H32O2/c1-16-13-20(24(2,3)4)22(21(14-16)25(5,6)7)27-23(26)19-15-18(19)17-11-9-8-10-12-17/h8-14,18-19H,15H2,1-7H3
InChIKey UUPYWCABPJTTSB-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C25H32O2
Exact Mass 364.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8xg922DuBJt
Name Cyclopropanecarboxylic acid, 2-phenyl-, 2,6-bis(1,1-dimethylethyl)-4-methylphenyl ester
Alternate Name(s) (2,6-ditert-butyl-4-methyl-phenyl) 2-phenylcyclopropane-1-carboxylate 2,6-Ditert-butyl-4-methylphenyl 2-phenylcyclopropanecarboxylate (2,6-ditert-butyl-4-methyl-phenyl) 2-phenylcyclopropanecarboxylate 2-phenyl-1-cyclopropanecarboxylic acid (2,6-ditert-butyl-4-methylphenyl) ester 2-phenylcyclopropanecarboxylic acid (2,6-ditert-butyl-4-methyl-phenyl) ester (2,6-ditert-butyl-4-methylphenyl) 2-phenylcyclopropane-1-carboxylate
CAS Registry Number 108546-83-4
Comments Less than 3 mono-isotopic peaks
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Formula C25H32O2
InChI InChI=1S/C25H32O2/c1-16-13-20(24(2,3)4)22(21(14-16)25(5,6)7)27-23(26)19-15-18(19)17-11-9-8-10-12-17/h8-14,18-19H,15H2,1-7H3
InChIKey UUPYWCABPJTTSB-UHFFFAOYSA-N
Molecular Weight 364.529 g/mol
SMILES CC(c1c(OC(C2C(C2)c2ccccc2)=O)c(cc(c1)C)C(C)(C)C)(C)C
SPLASH splash10-0002-0900000000-3b6a9ac7f221a904d419
Source of Spectrum H-69-1663-25
Wiley ID 1351170