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Glutaric acid monoamide, N-(1,2,3,4-tetrahydronaphth-1-yl)-, hexyl ester
SpectraBase Compound ID 8leEVmqwlmu
InChI InChI=1S/C21H31NO3/c1-2-3-4-7-16-25-21(24)15-9-14-20(23)22-19-13-8-11-17-10-5-6-12-18(17)19/h5-6,10,12,19H,2-4,7-9,11,13-16H2,1H3,(H,22,23)
InChIKey FXOCLNOECOSQTI-UHFFFAOYSA-N
Mol Weight 345.48 g/mol
Molecular Formula C21H31NO3
Exact Mass 345.230394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9WnwsGAamoE
Name Glutaric acid monoamide, N-(1,2,3,4-tetrahydronaphth-1-yl)-, hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 345.230393859 u
Formula C21H31NO3
InChI InChI=1S/C21H31NO3/c1-2-3-4-7-16-25-21(24)15-9-14-20(23)22-19-13-8-11-17-10-5-6-12-18(17)19/h5-6,10,12,19H,2-4,7-9,11,13-16H2,1H3,(H,22,23)
InChIKey FXOCLNOECOSQTI-UHFFFAOYSA-N
Molecular Weight 345.483 g/mol
SMILES CCCCCCOC(CCCC(NC1C2=C(CCC1)C=CC=C2)=O)=O