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2-Cyclohexenone, 4R-benzamido-5cis,6trans-dimethoxy-

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-Cyclohexenone, 4R-benzamido-5cis,6trans-dimethoxy-
SpectraBase Compound ID 9pDmzfouFQF
InChI InChI=1S/C15H17NO4/c1-19-13-11(8-9-12(17)14(13)20-2)16-15(18)10-6-4-3-5-7-10/h3-9,11,13-14H,1-2H3,(H,16,18)
InChIKey IHHNNROYNVOWIR-UHFFFAOYSA-N
Mol Weight 275.3 g/mol
Molecular Formula C15H17NO4
Exact Mass 275.115758 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LbhThh5EQ4D
Name 2-Cyclohexenone, 4R-benzamido-5cis,6trans-dimethoxy-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 275.115758027 u
Formula C15H17NO4
InChI InChI=1S/C15H17NO4/c1-19-13-11(8-9-12(17)14(13)20-2)16-15(18)10-6-4-3-5-7-10/h3-9,11,13-14H,1-2H3,(H,16,18)
InChIKey IHHNNROYNVOWIR-UHFFFAOYSA-N
SMILES C1=CC(C(NC2C(OC)C(OC)C(=O)C=C2)=O)=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.940744