| SpectraBase Spectrum ID |
Kll3eKwRt0U |
| Name |
Methyl 3-[(3-methoxy-3-oxopropyl)(nitroso)amino]propanoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
218.090271554 u |
| Formula |
C8H14N2O5 |
| InChI |
InChI=1S/C8H14N2O5/c1-14-7(11)3-5-10(9-13)6-4-8(12)15-2/h3-6H2,1-2H3 |
| InChIKey |
SHMBNCVRVKCIAE-UHFFFAOYSA-N |
| Molecular Weight |
218.209 g/mol |
| SMILES |
COC(=O)CCN(CCC(OC)=O)N=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.976333 |