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4-Bromo-7-tert-butyl-3-hydroxy-2-naphthalenecarboxylic acid methyl ester
SpectraBase Compound ID GKMPu8JJ5VW
InChI InChI=1S/C16H17BrO3/c1-16(2,3)10-5-6-11-9(7-10)8-12(15(19)20-4)14(18)13(11)17/h5-8,18H,1-4H3
InChIKey VEMOQARYLLXPTF-UHFFFAOYSA-N
Mol Weight 337.21 g/mol
Molecular Formula C16H17BrO3
Exact Mass 336.036107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXCnjJdJFqU
Name 4-Bromo-7-tert-butyl-3-hydroxy-2-naphthalenecarboxylic acid methyl ester
Alternate Name(s) 4-Bromo-7-tert-butyl-3-hydroxy-naphthalene-2-carboxylic acid methyl ester Methyl 4-bromanyl-7-tert-butyl-3-oxidanyl-naphthalene-2-carboxylate Methyl 4-bromo-7-tert-butyl-3-hydroxy-naphthalene-2-carboxylate
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Formula C16H17BrO3
InChI InChI=1S/C16H17BrO3/c1-16(2,3)10-5-6-11-9(7-10)8-12(15(19)20-4)14(18)13(11)17/h5-8,18H,1-4H3
InChIKey VEMOQARYLLXPTF-UHFFFAOYSA-N
Molecular Weight 337.213 g/mol
SMILES Oc1c(cc2c(c1Br)ccc(c2)C(C)(C)C)C(=O)OC
SPLASH splash10-0k9i-0039000000-403730e5eb98448315a6
Source of Spectrum J-66-1477-12
Wiley ID 1534649