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Methyl 5-chloro-2-hydroxy-4-isopropoxy-6-methylbenzoate
SpectraBase Compound ID 57RpcHPgO8R
InChI InChI=1S/C12H15ClO4/c1-6(2)17-9-5-8(14)10(12(15)16-4)7(3)11(9)13/h5-6,14H,1-4H3
InChIKey CTPHHBPTPBJHPO-UHFFFAOYSA-N
Mol Weight 258.7 g/mol
Molecular Formula C12H15ClO4
Exact Mass 258.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4lkhCgc79P
Name Methyl 5-chloro-2-hydroxy-4-isopropoxy-6-methylbenzoate
Alternate Name(s) Methyl 3-chloro-6-hydroxy-4-isopropoxy-2-methylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15ClO4
InChI InChI=1S/C12H15ClO4/c1-6(2)17-9-5-8(14)10(12(15)16-4)7(3)11(9)13/h5-6,14H,1-4H3
InChIKey CTPHHBPTPBJHPO-UHFFFAOYSA-N
Molecular Weight 258.701 g/mol
SMILES Oc1c(C(=O)OC)c(c(c(c1)OC(C)C)Cl)C
SPLASH splash10-053r-0940000000-74c740f8cebc00f1f3b4
Source of Spectrum X2-49-115-17
Wiley ID 1601812