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Phthalic acid, monoamide, N,N-dinonyl, butyl ester

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Phthalic acid, monoamide, N,N-dinonyl, butyl ester
SpectraBase Compound ID 1KdmgtX0dyT
InChI InChI=1S/C30H51NO3/c1-4-7-10-12-14-16-20-24-31(25-21-17-15-13-11-8-5-2)29(32)27-22-18-19-23-28(27)30(33)34-26-9-6-3/h18-19,22-23H,4-17,20-21,24-26H2,1-3H3
InChIKey CHZXLSBUGACKGH-UHFFFAOYSA-N
Mol Weight 473.7 g/mol
Molecular Formula C30H51NO3
Exact Mass 473.386895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5SJrfDuvx6f
Name Phthalic acid, monoamide, N,N-dinonyl, butyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.386894503 u
Formula C30H51NO3
InChI InChI=1S/C30H51NO3/c1-4-7-10-12-14-16-20-24-31(25-21-17-15-13-11-8-5-2)29(32)27-22-18-19-23-28(27)30(33)34-26-9-6-3/h18-19,22-23H,4-17,20-21,24-26H2,1-3H3
InChIKey CHZXLSBUGACKGH-UHFFFAOYSA-N
Molecular Weight 473.742 g/mol
SMILES CCCCOC(C1=C(C(N(CCCCCCCCC)CCCCCCCCC)=O)C=CC=C1)=O