| SpectraBase Spectrum ID |
G2DcmT0RHga |
| Name |
3-[5-(4-Methyl-piperazin-1-yl)-2-nitro-phenylamino]-propan-1-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
294.169190581 u |
| Formula |
C14H22N4O3 |
| InChI |
InChI=1S/C14H22N4O3/c1-16-6-8-17(9-7-16)12-3-4-14(18(20)21)13(11-12)15-5-2-10-19/h3-4,11,15,19H,2,5-10H2,1H3 |
| InChIKey |
PYZXEPLLFDIQLF-UHFFFAOYSA-N |
| SMILES |
C(O)CCNC1=C(N(=O)=O)C=CC(=C1)N1CCN(C)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948804 |
![3-[5-(4-Methyl-piperazin-1-yl)-2-nitro-phenylamino]-propan-1-ol](/api/spectrum/G2DcmT0RHga/structure.png?h=300&w=458 "3-[5-(4-Methyl-piperazin-1-yl)-2-nitro-phenylamino]-propan-1-ol")
