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Phthalic acid, monoamide, N,N-dibutyl-, heptyl ester

View entire compound with spectra: 1 NMR

Phthalic acid, monoamide, N,N-dibutyl-, heptyl ester
SpectraBase Compound ID JzEvn2lhcDh
InChI InChI=1S/C23H37NO3/c1-4-7-10-11-14-19-27-23(26)21-16-13-12-15-20(21)22(25)24(17-8-5-2)18-9-6-3/h12-13,15-16H,4-11,14,17-19H2,1-3H3
InChIKey XRPWSHCRGMWAOJ-UHFFFAOYSA-N
Mol Weight 375.6 g/mol
Molecular Formula C23H37NO3
Exact Mass 375.277344 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JQdHLFdwhfh
Name Phthalic acid, monoamide, N,N-dibutyl-, heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 375.277344052 u
Formula C23H37NO3
InChI InChI=1S/C23H37NO3/c1-4-7-10-11-14-19-27-23(26)21-16-13-12-15-20(21)22(25)24(17-8-5-2)18-9-6-3/h12-13,15-16H,4-11,14,17-19H2,1-3H3
InChIKey XRPWSHCRGMWAOJ-UHFFFAOYSA-N
Molecular Weight 375.553 g/mol
SMILES C1(=C(C=CC=C1)C(=O)OCCCCCCC)C(N(CCCC)CCCC)=O