| SpectraBase Spectrum ID |
2MiQiwNbjiW |
| Name |
1-Azetidineacetic acid, 3,3-dimethyl-.alpha.-(1-methylethylidene)-2-oxo-, methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
211.120843408 u |
| Formula |
C11H17NO3 |
| InChI |
InChI=1S/C11H17NO3/c1-7(2)8(9(13)15-5)12-6-11(3,4)10(12)14/h6H2,1-5H3 |
| InChIKey |
LVKFITJFCRJJAO-UHFFFAOYSA-N |
| Molecular Weight |
211.261 g/mol |
| SMILES |
C1(N(CC1(C)C)C(C(=O)OC)=C(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872074 |
