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Glutaric acid, monoamide, N-(2-ethylphenyl)-, pentyl ester
SpectraBase Compound ID Bm2cs2uKFdG
InChI InChI=1S/C18H27NO3/c1-3-5-8-14-22-18(21)13-9-12-17(20)19-16-11-7-6-10-15(16)4-2/h6-7,10-11H,3-5,8-9,12-14H2,1-2H3,(H,19,20)
InChIKey OQSIVVCCZZKCTB-UHFFFAOYSA-N
Mol Weight 305.42 g/mol
Molecular Formula C18H27NO3
Exact Mass 305.199094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VfMN2nTvhO
Name Glutaric acid, monoamide, N-(2-ethylphenyl)-, pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 305.199093730 u
Formula C18H27NO3
InChI InChI=1S/C18H27NO3/c1-3-5-8-14-22-18(21)13-9-12-17(20)19-16-11-7-6-10-15(16)4-2/h6-7,10-11H,3-5,8-9,12-14H2,1-2H3,(H,19,20)
InChIKey OQSIVVCCZZKCTB-UHFFFAOYSA-N
Molecular Weight 305.418 g/mol
SMILES C1=CC=C(C(=C1)NC(CCCC(OCCCCC)=O)=O)CC