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2,6-Di(tert-butyl)-4-methylphenyl 1- methyl-2-phenylcyclopropanecarboxylate
SpectraBase Compound ID JMVmstMABQ6
InChI InChI=1S/C26H34O2/c1-17-14-19(24(2,3)4)22(20(15-17)25(5,6)7)28-23(27)26(8)16-21(26)18-12-10-9-11-13-18/h9-15,21H,16H2,1-8H3
InChIKey AWHKEVVHFZKCBL-UHFFFAOYSA-N
Mol Weight 378.6 g/mol
Molecular Formula C26H34O2
Exact Mass 378.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9qXIVlFVTAU
Name 2,6-di(tert-butyl)-4-methylphenyl 1- methyl-2-phenylcyclopropanecarboxylate
Alternate Name(s) (cis/trans)-2,6-Di-t-Butyl-4-methylphenyl 1-methyl-2-phenylcyclopropane-1-carboxylate 2,6-Di-tert-butyl-4-methylphenyl 1-methyl-2-phenylcyclopropane-1-carboxylate 2,6-ditert-butyl-4-methylphenyl 1-methyl-2-phenylcyclopropanecarboxylate
CAS Registry Number 108546-93-6
Comments Less than 3 mono-isotopic peaks
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Formula C26H34O2
InChI InChI=1S/C26H34O2/c1-17-14-19(24(2,3)4)22(20(15-17)25(5,6)7)28-23(27)26(8)16-21(26)18-12-10-9-11-13-18/h9-15,21H,16H2,1-8H3
InChIKey AWHKEVVHFZKCBL-UHFFFAOYSA-N
Molecular Weight 378.556 g/mol
SMILES C1(C(c2ccccc2)C1)(C(Oc1c(C(C)(C)C)cc(cc1C(C)(C)C)C)=O)C
SPLASH splash10-0a4i-0900000000-6762f42d1b13c1d333b6
Source of Spectrum H-69-1663-30
Wiley ID 1359084