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Crystal violet base

View entire compound with spectra: 5 NMR, 1 FTIR, and 1 Raman

Crystal violet base
SpectraBase Compound ID DCvkEsaFGmA
InChI InChI=1S/C25H31N3O/c1-26(2)22-13-7-19(8-14-22)25(29,20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6/h7-18,29H,1-6H3
InChIKey QFVDKARCPMTZCS-UHFFFAOYSA-N
Mol Weight 389.54 g/mol
Molecular Formula C25H31N3O
Exact Mass 389.246713 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID H730ASaDZMB
Name Crystal violet base
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 389.246712629 u
Formula C25H31N3O
InChI InChI=1S/C25H31N3O/c1-26(2)22-13-7-19(8-14-22)25(29,20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6/h7-18,29H,1-6H3
InChIKey QFVDKARCPMTZCS-UHFFFAOYSA-N
Molecular Weight 389.543 g/mol
SMILES OC(C=1C=CC(=CC1)N(C)C)(C=1C=CC(=CC1)N(C)C)C=1C=CC(=CC1)N(C)C
Spectrum/Structure Validation Score (Raman) 0.917316