SpectraBase Spectrum ID |
7w6nG4lgeeP |
Name |
N-(7-Amino-2,3-dihydro-benzo[1,4]dioxin-6-yl)-acetamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
208.084792251 u |
Formula |
C10H12N2O3 |
InChI |
InChI=1S/C10H12N2O3/c1-6(13)12-8-5-10-9(4-7(8)11)14-2-3-15-10/h4-5H,2-3,11H2,1H3,(H,12,13) |
InChIKey |
LJXBBVIIWHUUSY-UHFFFAOYSA-N |
Molecular Weight |
208.217 g/mol |
SMILES |
C1(=CC=2OCCOC2C=C1N)NC(=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948428 |