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o,N-Dimethyl-dehydrococcinine

View entire compound with spectra: 1 FTIR

o,N-Dimethyl-dehydrococcinine
SpectraBase Compound ID EZHoi8yestr
InChI InChI=1S/C19H21NO4/c1-20-9-13-7-18-19(24-11-23-18)8-14(13)15(10-20)12-4-5-16(21-2)17(6-12)22-3/h4-8,15H,9-11H2,1-3H3
InChIKey HWZPAIGPNUNNKM-UHFFFAOYSA-N
Mol Weight 327.38 g/mol
Molecular Formula C19H21NO4
Exact Mass 327.147058 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2R0mGmCM09d
Name o,N-Dimethyl-dehydrococcinine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.147058156 u
Formula C19H21NO4
InChI InChI=1S/C19H21NO4/c1-20-9-13-7-18-19(24-11-23-18)8-14(13)15(10-20)12-4-5-16(21-2)17(6-12)22-3/h4-8,15H,9-11H2,1-3H3
InChIKey HWZPAIGPNUNNKM-UHFFFAOYSA-N
Molecular Weight 327.380 g/mol
SMILES C12=C(C=C3C(=C2)OCO3)C(CN(C1)C)C1=CC(=C(C=C1)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.958389