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(5-tert-butyl-2,3-dimethyl-phenyl) benzoate
SpectraBase Compound ID FtMwWPpBVbe
InChI InChI=1S/C19H22O2/c1-13-11-16(19(3,4)5)12-17(14(13)2)21-18(20)15-9-7-6-8-10-15/h6-12H,1-5H3
InChIKey DIDLTANAZZBZGK-UHFFFAOYSA-N
Mol Weight 282.38 g/mol
Molecular Formula C19H22O2
Exact Mass 282.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDbJDvsGWdO
Name (5-tert-butyl-2,3-dimethyl-phenyl) benzoate
Comments Removed - expert review: contamination (CHCl3); A corrected record has been addded having SpectrumID: 1821430
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Formula C19H22O2
InChI InChI=1S/C19H22O2/c1-13-11-16(19(3,4)5)12-17(14(13)2)21-18(20)15-9-7-6-8-10-15/h6-12H,1-5H3
InChIKey DIDLTANAZZBZGK-UHFFFAOYSA-N
Molecular Weight 282.383 g/mol
SMILES c1(OC(=O)c2ccccc2)c(c(C)cc(c1)C(C)(C)C)C
SPLASH splash10-0a59-9400000000-9ecaa89e3bf64dca55d5
Source of Spectrum K1-2001-3060-13
Synonyms benzoic acid (5-tert-butyl-2,3-dimethyl-phenyl) ester benzoic acid (5-tert-butyl-2,3-dimethylphenyl) ester
Wiley ID 814095