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N-(1-adamantylmethyl)-3-methyl-1-benzofuran-2-carboxamide

View entire compound with spectra: 2 NMR

N-(1-adamantylmethyl)-3-methyl-1-benzofuran-2-carboxamide
SpectraBase Compound ID 2xeYpPsoEEr
InChI InChI=1S/C21H25NO2/c1-13-17-4-2-3-5-18(17)24-19(13)20(23)22-12-21-9-14-6-15(10-21)8-16(7-14)11-21/h2-5,14-16H,6-12H2,1H3,(H,22,23)
InChIKey XVKAJBWXUGOGNO-UHFFFAOYSA-N
Mol Weight 323.44 g/mol
Molecular Formula C21H25NO2
Exact Mass 323.188529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8wOLmJG18jn
Name N-(1-Adamantylmethyl)-3-methyl-1-benzofuran-2-carboxamide
Comments Computed using HOSE algorithm
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Exact Mass 323.188529047 u
Formula C21H25NO2
InChI InChI=1S/C21H25NO2/c1-13-17-4-2-3-5-18(17)24-19(13)20(23)22-12-21-9-14-6-15(10-21)8-16(7-14)11-21/h2-5,14-16H,6-12H2,1H3,(H,22,23)
InChIKey XVKAJBWXUGOGNO-UHFFFAOYSA-N
Molecular Weight 323.436 g/mol
SMILES N(CC12CC3CC(C2)CC(C1)C3)C(C=1OC=2C=CC=CC2C1C)=O