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N-[2-(1-cyclohexen-1-yl)ethyl]-2-phenylbutanamide
SpectraBase Compound ID AJepU94MkUI
InChI InChI=1S/C18H25NO/c1-2-17(16-11-7-4-8-12-16)18(20)19-14-13-15-9-5-3-6-10-15/h4,7-9,11-12,17H,2-3,5-6,10,13-14H2,1H3,(H,19,20)
InChIKey DDDOZMFVJSGHSI-UHFFFAOYSA-N
Mol Weight 271.4 g/mol
Molecular Formula C18H25NO
Exact Mass 271.193614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E01gGqvhA8h
Name N-[2-(1-Cyclohexen-1-yl)ethyl]-2-phenylbutanamide
Comments Computed using HOSE algorithm
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Exact Mass 271.193614428 u
Formula C18H25NO
InChI InChI=1S/C18H25NO/c1-2-17(16-11-7-4-8-12-16)18(20)19-14-13-15-9-5-3-6-10-15/h4,7-9,11-12,17H,2-3,5-6,10,13-14H2,1H3,(H,19,20)
InChIKey DDDOZMFVJSGHSI-UHFFFAOYSA-N
Molecular Weight 271.404 g/mol
SMILES N(C(C(C=1C=CC=CC1)CC)=O)CCC1=CCCCC1