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N-(5-chloro-2-methoxyphenyl)-4-methyl-4-cyclohexene-1,2-dicarboximide

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

N-(5-chloro-2-methoxyphenyl)-4-methyl-4-cyclohexene-1,2-dicarboximide
SpectraBase Compound ID GbkfGIi6BOB
InChI InChI=1S/C16H16ClNO3/c1-9-3-5-11-12(7-9)16(20)18(15(11)19)13-8-10(17)4-6-14(13)21-2/h3-4,6,8,11-12H,5,7H2,1-2H3
InChIKey MXLYSSURFKUKOD-UHFFFAOYSA-N
Mol Weight 305.76 g/mol
Molecular Formula C16H16ClNO3
Exact Mass 305.081871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GoxSK8P9kQs
Name N-(5-Chloro-2-methoxyphenyl)-4-methyl-4-cyclohexene-1,2-dicarboximide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.081871076 u
Formula C16H16ClNO3
InChI InChI=1S/C16H16ClNO3/c1-9-3-5-11-12(7-9)16(20)18(15(11)19)13-8-10(17)4-6-14(13)21-2/h3-4,6,8,11-12H,5,7H2,1-2H3
InChIKey MXLYSSURFKUKOD-UHFFFAOYSA-N
Molecular Weight 305.761 g/mol
SMILES C1C2C(N(C(C2CC(=C1)C)=O)C=1C=C(C=CC1OC)Cl)=O