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6-[(Mesitylamino)carbonyl]-3-cyclohexene-1-carboxylic acid

View entire compound with spectra: 2 NMR

6-[(Mesitylamino)carbonyl]-3-cyclohexene-1-carboxylic acid
SpectraBase Compound ID Gf8jtajXBYe
InChI InChI=1S/C17H21NO3/c1-10-8-11(2)15(12(3)9-10)18-16(19)13-6-4-5-7-14(13)17(20)21/h4-5,8-9,13-14H,6-7H2,1-3H3,(H,18,19)(H,20,21)
InChIKey TUVXBGLHYWSPRR-UHFFFAOYSA-N
Mol Weight 287.36 g/mol
Molecular Formula C17H21NO3
Exact Mass 287.152144 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3ib2rGEcZW4
Name 6-[(Mesitylamino)carbonyl]-3-cyclohexene-1-carboxylic acid
Comments Computed using HOSE algorithm
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Exact Mass 287.152143537 u
Formula C17H21NO3
InChI InChI=1S/C17H21NO3/c1-10-8-11(2)15(12(3)9-10)18-16(19)13-6-4-5-7-14(13)17(20)21/h4-5,8-9,13-14H,6-7H2,1-3H3,(H,18,19)(H,20,21)
InChIKey TUVXBGLHYWSPRR-UHFFFAOYSA-N
Molecular Weight 287.359 g/mol
SMILES N(C(C1C(C(=O)O)CC=CC1)=O)C=1C(=CC(=CC1C)C)C