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Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, isohexyl ester

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Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, isohexyl ester
SpectraBase Compound ID 8x23ObBNupD
InChI InChI=1S/C18H26ClNO4/c1-13(2)6-5-11-24-18(22)8-4-7-17(21)20-15-12-14(19)9-10-16(15)23-3/h9-10,12-13H,4-8,11H2,1-3H3,(H,20,21)
InChIKey HFYCAOMIOQGBEQ-UHFFFAOYSA-N
Mol Weight 355.86 g/mol
Molecular Formula C18H26ClNO4
Exact Mass 355.155036 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E9RxV1AeRzU
Name Glutaric acid, monoamide, N-(5-chloro-2-methoxyphenyl)-, isohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 355.155036017 u
Formula C18H26ClNO4
InChI InChI=1S/C18H26ClNO4/c1-13(2)6-5-11-24-18(22)8-4-7-17(21)20-15-12-14(19)9-10-16(15)23-3/h9-10,12-13H,4-8,11H2,1-3H3,(H,20,21)
InChIKey HFYCAOMIOQGBEQ-UHFFFAOYSA-N
Molecular Weight 355.862 g/mol
SMILES CC(C)CCCOC(CCCC(NC1=CC(=CC=C1OC)Cl)=O)=O