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Benzoic acid, 3-chloro-6-hydroxy-2-methyl-4-(phenylmethoxy)-, ethyl ester
SpectraBase Compound ID 3KcqGFqOvHy
InChI InChI=1S/C17H17ClO4/c1-3-21-17(20)15-11(2)16(18)14(9-13(15)19)22-10-12-7-5-4-6-8-12/h4-9,19H,3,10H2,1-2H3
InChIKey BHVXFDZDRLGQIM-UHFFFAOYSA-N
Mol Weight 320.77 g/mol
Molecular Formula C17H17ClO4
Exact Mass 320.081537 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5hUli9SqD5n
Name Benzoic acid, 3-chloro-6-hydroxy-2-methyl-4-(phenylmethoxy)-, ethyl ester
CAS Registry Number 131524-44-2
Comments Less than 3 mono-isotopic peaks
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Formula C17H17ClO4
InChI InChI=1S/C17H17ClO4/c1-3-21-17(20)15-11(2)16(18)14(9-13(15)19)22-10-12-7-5-4-6-8-12/h4-9,19H,3,10H2,1-2H3
InChIKey BHVXFDZDRLGQIM-UHFFFAOYSA-N
Molecular Weight 320.772 g/mol
SMILES Oc1c(c(c(Cl)c(c1)OCc1ccccc1)C)C(=O)OCC
SPLASH splash10-0006-9001000000-bed09ee787a5d12c9eeb
Source of Spectrum B-43-1751-0
Synonyms ethyl 4-(benzyloxy)-3-chloro-6-hydroxy-2-methylbenzoate
Wiley ID 1319991