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Phenol, 4-methyl-2-(1-methylethyl)-, propanoate
SpectraBase Compound ID J178aMD9DN8
InChI InChI=1S/C13H18O2/c1-5-13(14)15-12-7-6-10(4)8-11(12)9(2)3/h6-9H,5H2,1-4H3
InChIKey OTTWTNJDQNFXJS-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5pS8PIAehOn
Name Phenol, 4-methyl-2-(1-methylethyl)-, propanoate
Alternate Name(s) 2-isopropyl-4-methylphenyl propionate 4-Methyl-2-(1-methylethyl)phenyl propanoate propanoic acid (4-methyl-2-propan-2-ylphenyl) ester (4-methyl-2-propan-2-ylphenyl) propanoate (2-isopropyl-4-methyl-phenyl) propanoate (4-methyl-2-propan-2-yl-phenyl) propanoate
CAS Registry Number 129375-05-9
Comments Less than 3 mono-isotopic peaks
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Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-5-13(14)15-12-7-6-10(4)8-11(12)9(2)3/h6-9H,5H2,1-4H3
InChIKey OTTWTNJDQNFXJS-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES c1(c(cc(cc1)C)C(C)C)OC(=O)CC
SPLASH splash10-0udi-0940000000-5d402bca5bb68572d6d6
Source of Spectrum AH-121-233-18
Wiley ID 1204779