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Ethyl 4-(2-bromoethyl)-6-hexyl-1-hydroxy-3,5-dimethyl-2-benzoate
SpectraBase Compound ID IJ6uomPXAP5
InChI InChI=1S/C19H29BrO3/c1-5-7-8-9-10-16-13(3)15(11-12-20)14(4)17(18(16)21)19(22)23-6-2/h21H,5-12H2,1-4H3
InChIKey DDDXPWAHMDQXJV-UHFFFAOYSA-N
Mol Weight 385.34 g/mol
Molecular Formula C19H29BrO3
Exact Mass 384.130008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Idyp4XuMQw9
Name Ethyl 4-(2-bromoethyl)-6-hexyl-1-hydroxy-3,5-dimethyl-2-benzoate
Alternate Name(s) 5-(2-bromoethyl)-3-hexyl-2-hydroxy-4,6-dimethylbenzoic acid ethyl ester Ethyl 5-(2-bromoethyl)-3-hexyl-2-hydroxy-4,6-dimethylbenzoate Ethyl 5-(2-bromoethyl)-3-hexyl-2-hydroxy-4,6-dimethyl-benzoate Ethyl 3-(2-bromoethyl)-5-hexyl-2,4-dimethyl-6-oxidanyl-benzoate
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Formula C19H29BrO3
InChI InChI=1S/C19H29BrO3/c1-5-7-8-9-10-16-13(3)15(11-12-20)14(4)17(18(16)21)19(22)23-6-2/h21H,5-12H2,1-4H3
InChIKey DDDXPWAHMDQXJV-UHFFFAOYSA-N
Molecular Weight 385.342 g/mol
SMILES Oc1c(c(c(c(C)c1CCCCCC)CCBr)C)C(=O)OCC
SPLASH splash10-004i-9110000000-386ffa690015a4fb96ee
Source of Spectrum F-69-9134-3
Wiley ID 1595958