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Benzoic acid, 3-[(2,2-dimethyl-1-oxobutyl)amino]-5-(3-methylbutyl)-, methyl ester
SpectraBase Compound ID EXxWF7A5pDd
InChI InChI=1S/C19H29NO3/c1-7-19(4,5)18(22)20-16-11-14(9-8-13(2)3)10-15(12-16)17(21)23-6/h10-13H,7-9H2,1-6H3,(H,20,22)
InChIKey UEDYNURRYWAWOG-UHFFFAOYSA-N
Mol Weight 319.44 g/mol
Molecular Formula C19H29NO3
Exact Mass 319.214744 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXF8aG96shO
Name Benzoic acid, 3-[(2,2-dimethyl-1-oxobutyl)amino]-5-(3-methylbutyl)-, methyl ester
CAS Registry Number 55044-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H29NO3
InChI InChI=1S/C19H29NO3/c1-7-19(4,5)18(22)20-16-11-14(9-8-13(2)3)10-15(12-16)17(21)23-6/h10-13H,7-9H2,1-6H3,(H,20,22)
InChIKey UEDYNURRYWAWOG-UHFFFAOYSA-N
Molecular Weight 319.445 g/mol
SMILES N(c1cc(cc(c1)C(=O)OC)CCC(C)C)C(C(C)(C)CC)=O
SPLASH splash10-00xu-9320000000-76c2dceb1967ad96b101
Source of Spectrum AD-0-4863-0
Synonyms Methyl 3-[(2,2-dimethylbutanoyl)amino]-5-isopentylbenzoate 3-(2,2-dimethylbutanoylamino)-5-isoamyl-benzoic acid methyl ester 3-[(2,2-dimethyl-1-oxobutyl)amino]-5-(3-methylbutyl)benzoic acid methyl ester Methyl 3-(2,2-dimethylbutanoylamino)-5-(3-methylbutyl)benzoate
Wiley ID 47672