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Benzoic acid, 2,5-dimethyl-, (2,4-dimethylphenyl)methyl ester
SpectraBase Compound ID HDQpa2O9D4G
InChI InChI=1S/C18H20O2/c1-12-6-8-16(15(4)9-12)11-20-18(19)17-10-13(2)5-7-14(17)3/h5-10H,11H2,1-4H3
InChIKey IENKFXNUDJZDBB-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C18H20O2
Exact Mass 268.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5Zd1dvp0tC
Name Benzoic acid, 2,5-dimethyl-, (2,4-dimethylphenyl)methyl ester
Alternate Name(s) 2,4-Dimethylbenzyl 2,5-dimethylbenzoate (2,4-dimethylphenyl)methyl 2,5-dimethylbenzoate 2,4-Dimethylbenzyl-2,5-dimethylbenzoate 2,5-Dimethylbenzoic acid (2,4-dimethylbenzyl) ester 2,5-Dimethylbenzoic acid (2,4-dimethylphenyl)methyl ester
CAS Registry Number 55000-48-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2
InChI InChI=1S/C18H20O2/c1-12-6-8-16(15(4)9-12)11-20-18(19)17-10-13(2)5-7-14(17)3/h5-10H,11H2,1-4H3
InChIKey IENKFXNUDJZDBB-UHFFFAOYSA-N
Molecular Weight 268.356 g/mol
SMILES Cc1ccc(COC(c2cc(C)ccc2C)=O)c(C)c1
SPLASH splash10-014i-1900000000-caee017c6b01666cb7e7
Source of Spectrum AA-0-1816-3
Wiley ID 38813