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4-[N-Methylpiperazin-1-yl]-5-amino veratrole

View entire compound with spectra: 1 FTIR

4-[N-Methylpiperazin-1-yl]-5-amino veratrole
SpectraBase Compound ID BIF32zaSyRt
InChI InChI=1S/C13H21N3O2/c1-15-4-6-16(7-5-15)11-9-13(18-3)12(17-2)8-10(11)14/h8-9H,4-7,14H2,1-3H3
InChIKey QQDOAASJHZPURL-UHFFFAOYSA-N
Mol Weight 251.33 g/mol
Molecular Formula C13H21N3O2
Exact Mass 251.163377 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID g911lrswIO
Name 4-[N-Methylpiperazin-1-yl]-5-amino veratrole
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.163376926 u
Formula C13H21N3O2
InChI InChI=1S/C13H21N3O2/c1-15-4-6-16(7-5-15)11-9-13(18-3)12(17-2)8-10(11)14/h8-9H,4-7,14H2,1-3H3
InChIKey QQDOAASJHZPURL-UHFFFAOYSA-N
Molecular Weight 251.330 g/mol
SMILES C1=C(C(N2CCN(CC2)C)=CC(=C1OC)OC)N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941134