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Ethyl methyl 2,4-dimethylisophthalate
SpectraBase Compound ID Iq2RZAXEJ1P
InChI InChI=1S/C13H16O4/c1-5-17-12(14)10-7-6-8(2)11(9(10)3)13(15)16-4/h6-7H,5H2,1-4H3
InChIKey ZRWYFOKSVNCRBY-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9YjRQHbT7HK
Name Ethyl methyl 2,4-dimethylisophthalate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-5-17-12(14)10-7-6-8(2)11(9(10)3)13(15)16-4/h6-7H,5H2,1-4H3
InChIKey ZRWYFOKSVNCRBY-UHFFFAOYSA-N
Instrument Name HP G1800C GCD Series II
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.c04
Molecular Weight 236.267 g/mol
SMILES C(C)OC(c1c(c(c(cc1)C)C(=O)OC)C)=O
SPLASH splash10-0a73-4590000000-a9e76fa148faab74e6e8
Source of Spectrum ARK-2007-53-11a
Thin-Layer Chromatography Rf = 0.57 (30% acetone/hexanes)
Wiley ID 1871391