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N-Acetyl-1-(2,3-dimethoxy-6-N-methylbenzenyl)cyclohexanol
SpectraBase Compound ID 38RNMcYAMbb
InChI InChI=1S/C18H27NO4/c1-13(20)19(2)12-14-8-9-15(22-3)17(23-4)16(14)18(21)10-6-5-7-11-18/h8-9,21H,5-7,10-12H2,1-4H3
InChIKey NFHVLKMLLFEIPA-UHFFFAOYSA-N
Mol Weight 321.42 g/mol
Molecular Formula C18H27NO4
Exact Mass 321.194008 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6gGYNaoniNa
Name N-Acetyl-1-(2,3-dimethoxy-6-N-methylbenzenyl)cyclohexanol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.194008349 u
Formula C18H27NO4
InChI InChI=1S/C18H27NO4/c1-13(20)19(2)12-14-8-9-15(22-3)17(23-4)16(14)18(21)10-6-5-7-11-18/h8-9,21H,5-7,10-12H2,1-4H3
InChIKey NFHVLKMLLFEIPA-UHFFFAOYSA-N
Molecular Weight 321.417 g/mol
SMILES C1(CCCCC1)(C1=C(C=CC(=C1OC)OC)CN(C)C(C)=O)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.806067