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Hexanoic acid, 6-[(diphenylacetyl)amino]-, phenylmethyl ester
SpectraBase Compound ID 8Wl97Vj8EIa
InChI InChI=1S/C27H29NO3/c29-25(31-21-22-13-5-1-6-14-22)19-11-4-12-20-28-27(30)26(23-15-7-2-8-16-23)24-17-9-3-10-18-24/h1-3,5-10,13-18,26H,4,11-12,19-21H2,(H,28,30)
InChIKey OCMCDAMQAAPRLT-UHFFFAOYSA-N
Mol Weight 415.53 g/mol
Molecular Formula C27H29NO3
Exact Mass 415.214744 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C64sipajlBJ
Name Hexanoic acid, 6-[(diphenylacetyl)amino]-, phenylmethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 415.214743795 u
Formula C27H29NO3
InChI InChI=1S/C27H29NO3/c29-25(31-21-22-13-5-1-6-14-22)19-11-4-12-20-28-27(30)26(23-15-7-2-8-16-23)24-17-9-3-10-18-24/h1-3,5-10,13-18,26H,4,11-12,19-21H2,(H,28,30)
InChIKey OCMCDAMQAAPRLT-UHFFFAOYSA-N
Molecular Weight 415.533 g/mol
SMILES N(C(C(C=1C=CC=CC1)C1=CC=CC=C1)=O)CCCCCC(=O)OCC=1C=CC=CC1