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Tetradecanamide, N-(3-chloro-5-fluoro-2-hydroxy-4-methylphenyl)-2-[3-(1,1-dimethylethyl)-4-hydroxyphenoxy]-
SpectraBase Compound ID BAxHAYuTf5Q
InChI InChI=1S/C31H45ClFNO4/c1-6-7-8-9-10-11-12-13-14-15-16-27(38-22-17-18-26(35)23(19-22)31(3,4)5)30(37)34-25-20-24(33)21(2)28(32)29(25)36/h17-20,27,35-36H,6-16H2,1-5H3,(H,34,37)
InChIKey VXPWFCZLKFBJRN-UHFFFAOYSA-N
Mol Weight 550.2 g/mol
Molecular Formula C31H45ClFNO4
Exact Mass 549.302115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3lczpLTPgdc
Name Tetradecanamide, N-(3-chloro-5-fluoro-2-hydroxy-4-methylphenyl)-2-[3-(1,1-dimethylethyl)-4-hydroxyphenoxy]-
Alternate Name(s) 2-(3-(tert-butyl)-4-hydroxyphenoxy)-N-(3-chloro-5-fluoro-2-hydroxy-4-methylphenyl)tetradecanamide 2-(3-tert-butyl-4-hydroxyphenoxy)-N-(3-chloro-5-fluoro-2-hydroxy-4-methylphenyl)tetradecanamide 2-(3-tert-butyl-4-hydroxy-phenoxy)-N-(3-chloro-5-fluoro-2-hydroxy-4-methyl-phenyl)tetradecanamide 2-(3-tert-butyl-4-oxidanyl-phenoxy)-N-(3-chloranyl-5-fluoranyl-4-methyl-2-oxidanyl-phenyl)tetradecanamide
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Formula C31H45ClFNO4
InChI InChI=1S/C31H45ClFNO4/c1-6-7-8-9-10-11-12-13-14-15-16-27(38-22-17-18-26(35)23(19-22)31(3,4)5)30(37)34-25-20-24(33)21(2)28(32)29(25)36/h17-20,27,35-36H,6-16H2,1-5H3,(H,34,37)
InChIKey VXPWFCZLKFBJRN-UHFFFAOYSA-N
Molecular Weight 550.155 g/mol
SMILES Oc1ccc(OC(C(=O)Nc2cc(c(c(c2O)Cl)C)F)CCCCCCCCCCCC)cc1C(C)(C)C
SPLASH splash10-066v-9601020000-2c0613f2b3fd4fee9bdd
Source of Spectrum JX-2015-4-1165
Wiley ID 1726559