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Diisopropyl 5-[(4-propoxybenzoyl)amino]isophthalate

View entire compound with spectra: 2 NMR

Diisopropyl 5-[(4-propoxybenzoyl)amino]isophthalate
SpectraBase Compound ID 3HIt9Vhsr3c
InChI InChI=1S/C24H29NO6/c1-6-11-29-21-9-7-17(8-10-21)22(26)25-20-13-18(23(27)30-15(2)3)12-19(14-20)24(28)31-16(4)5/h7-10,12-16H,6,11H2,1-5H3,(H,25,26)
InChIKey HMMOQKJESANWAR-UHFFFAOYSA-N
Mol Weight 427.5 g/mol
Molecular Formula C24H29NO6
Exact Mass 427.199488 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L9nf4SgbpBk
Name Diisopropyl 5-[(4-propoxybenzoyl)amino]isophthalate
Comments Computed using HOSE algorithm
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Exact Mass 427.199487652 u
Formula C24H29NO6
InChI InChI=1S/C24H29NO6/c1-6-11-29-21-9-7-17(8-10-21)22(26)25-20-13-18(23(27)30-15(2)3)12-19(14-20)24(28)31-16(4)5/h7-10,12-16H,6,11H2,1-5H3,(H,25,26)
InChIKey HMMOQKJESANWAR-UHFFFAOYSA-N
Molecular Weight 427.497 g/mol
SMILES N(C(C1=CC=C(C=C1)OCCC)=O)C=1C=C(C(OC(C)C)=O)C=C(C(OC(C)C)=O)C1