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2,6-Di-tert-butyl-4-methylphenyl 2,2-diphenylcyclopropane-1-carboxylate
SpectraBase Compound ID dWncVptVQK
InChI InChI=1S/C31H36O2/c1-21-18-24(29(2,3)4)27(25(19-21)30(5,6)7)33-28(32)26-20-31(26,22-14-10-8-11-15-22)23-16-12-9-13-17-23/h8-19,26H,20H2,1-7H3
InChIKey QPVOUNFTRMLKLD-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C31H36O2
Exact Mass 440.27153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lp06yoJKfwK
Name 2,6-Di-tert-butyl-4-methylphenyl 2,2-diphenylcyclopropane-1-carboxylate
Alternate Name(s) 2,6-Ditert-butyl-4-methylphenyl 2,2-diphenylcyclopropanecarboxylate
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Formula C31H36O2
InChI InChI=1S/C31H36O2/c1-21-18-24(29(2,3)4)27(25(19-21)30(5,6)7)33-28(32)26-20-31(26,22-14-10-8-11-15-22)23-16-12-9-13-17-23/h8-19,26H,20H2,1-7H3
InChIKey QPVOUNFTRMLKLD-UHFFFAOYSA-N
Molecular Weight 440.627 g/mol
SMILES C1(C(C1)(c1ccccc1)c1ccccc1)C(=O)Oc1c(cc(cc1C(C)(C)C)C)C(C)(C)C
SPLASH splash10-00di-1390000000-41988d14e4505f6e9103
Source of Spectrum QC-23-1708-0
Wiley ID 1584013