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Hexanoic acid, 4-(benzoylamino)-5-methyl-, methyl ester
SpectraBase Compound ID DzPa0T0B3wW
InChI InChI=1S/C15H21NO3/c1-11(2)13(9-10-14(17)19-3)16-15(18)12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3,(H,16,18)
InChIKey XTJMSLJMRWTILE-UHFFFAOYSA-N
Mol Weight 263.34 g/mol
Molecular Formula C15H21NO3
Exact Mass 263.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KYviRP7bRsz
Name Hexanoic acid, 4-(benzoylamino)-5-methyl-, methyl ester
Alternate Name(s) Methyl 4-(benzoylamino)-5-methylhexanoate Methyl 4-(phenylcarbonylamino)-heptanoate
CAS Registry Number 94287-45-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO3
InChI InChI=1S/C15H21NO3/c1-11(2)13(9-10-14(17)19-3)16-15(18)12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3,(H,16,18)
InChIKey XTJMSLJMRWTILE-UHFFFAOYSA-N
Molecular Weight 263.337 g/mol
SMILES N(C(=O)c1ccccc1)C(CCC(=O)OC)C(C)C
SPLASH splash10-0a4i-0910000000-06d48d56718e46eaf7db
Source of Spectrum F-42-4252-18
Wiley ID 1266962