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Piminodine HC l inkbr

View entire compound with spectra: 1 Raman

Piminodine HC l inkbr
SpectraBase Compound ID IGdYgqaPij2
InChI InChI=1S/C23H30N2O2.2ClH/c1-2-27-22(26)23(20-10-5-3-6-11-20)14-18-25(19-15-23)17-9-16-24-21-12-7-4-8-13-21;;/h3-8,10-13,24H,2,9,14-19H2,1H3;2*1H
InChIKey NNUYKVKCPSVJRZ-UHFFFAOYSA-N
Mol Weight 439.43 g/mol
Molecular Formula C23H32Cl2N2O2
Exact Mass 438.184084 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 5Tq9zVwwbwc
Name Piminodine HC l inkbr
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 438.184083676 u
Formula C23H32Cl2N2O2
InChI InChI=1S/C23H30N2O2.2ClH/c1-2-27-22(26)23(20-10-5-3-6-11-20)14-18-25(19-15-23)17-9-16-24-21-12-7-4-8-13-21;;/h3-8,10-13,24H,2,9,14-19H2,1H3;2*1H
InChIKey NNUYKVKCPSVJRZ-UHFFFAOYSA-N
Molecular Weight 439.427 g/mol
SMILES N(C1=CC=CC=C1)CCCN1CCC(CC1)(C(=O)OCC)C1=CC=CC=C1.Cl.Cl
Spectrum/Structure Validation Score (Raman) 0.925269