| SpectraBase Spectrum ID |
LObMNNXc8M3 |
| Name |
(2,3-Dihydro-1,4-benzodioxin-2-ylmethyl)[(4-nitrophenyl)methyl]amine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
300.111006999 u |
| Formula |
C16H16N2O4 |
| InChI |
InChI=1S/C16H16N2O4/c19-18(20)13-7-5-12(6-8-13)9-17-10-14-11-21-15-3-1-2-4-16(15)22-14/h1-8,14,17H,9-11H2 |
| InChIKey |
ZVFMCHZKQINZFX-UHFFFAOYSA-N |
| SMILES |
C1=CC=2OCC(OC2C=C1)CNCC1=CC=C(N(=O)=O)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.891918 |
![(2,3-Dihydro-1,4-benzodioxin-2-ylmethyl)[(4-nitrophenyl)methyl]amine](/api/spectrum/LObMNNXc8M3/structure.png?h=300&w=458 "(2,3-Dihydro-1,4-benzodioxin-2-ylmethyl)[(4-nitrophenyl)methyl]amine")
