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(+)-norreticuline, 6'-bromo-

View entire compound with spectra: 1 FTIR

(+)-norreticuline, 6'-bromo-
SpectraBase Compound ID 6GlLsoLdZ2M
InChI InChI=1S/C18H20BrNO4/c1-23-16-8-10-5-6-20-13(12(10)9-15(16)22)7-11-3-4-14(21)18(24-2)17(11)19/h3-4,8-9,13,20-22H,5-7H2,1-2H3
InChIKey GOPHFFTXXGOFGW-UHFFFAOYSA-N
Mol Weight 394.27 g/mol
Molecular Formula C18H20BrNO4
Exact Mass 393.057571 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JOA9inRDpVq
Name (+)-norreticuline, 6'-bromo-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 393.057571124 u
Formula C18H20BrNO4
InChI InChI=1S/C18H20BrNO4/c1-23-16-8-10-5-6-20-13(12(10)9-15(16)22)7-11-3-4-14(21)18(24-2)17(11)19/h3-4,8-9,13,20-22H,5-7H2,1-2H3
InChIKey GOPHFFTXXGOFGW-UHFFFAOYSA-N
Molecular Weight 394.265 g/mol
SMILES C1(=C(C=C2C(=C1)C(NCC2)CC=1C=CC(=C(OC)C1Br)O)OC)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.937925