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2,2'-(Trimethylenedioxy)dianiline, dihydrochloride

View entire compound with spectra: 1 Raman

2,2'-(Trimethylenedioxy)dianiline, dihydrochloride
SpectraBase Compound ID 8xVLrshy4ti
InChI InChI=1S/C15H18N2O2.ClH/c16-12-6-1-3-8-14(12)18-10-5-11-19-15-9-4-2-7-13(15)17;/h1-4,6-9H,5,10-11,16-17H2;1H
InChIKey AJJQFSAJQBJFFB-UHFFFAOYSA-N
Mol Weight 294.78 g/mol
Molecular Formula C15H19ClN2O2
Exact Mass 294.113506 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 9HCwBx7wCXU
Name 2,2'-(Trimethylenedioxy)dianiline, dihydrochloride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 294.113505558 u
Formula C15H19ClN2O2
InChI InChI=1S/C15H18N2O2.ClH/c16-12-6-1-3-8-14(12)18-10-5-11-19-15-9-4-2-7-13(15)17;/h1-4,6-9H,5,10-11,16-17H2;1H
InChIKey AJJQFSAJQBJFFB-UHFFFAOYSA-N
Molecular Weight 294.782 g/mol
Nominal Mass 294 u
SMILES Cl.NC=1C=CC=CC1OCCCOC=1C(=CC=CC1)N
Spectrum/Structure Validation Score (Raman) 0.956464