| SpectraBase Spectrum ID |
7Q6EW8uHCqS |
| Name |
(3S)-3-(Benzoyloxy)-1-pyrroline N-oxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
205.073893215 u |
| Formula |
C11H11NO3 |
| InChI |
InChI=1S/C11H11NO3/c13-11(9-4-2-1-3-5-9)15-10-6-7-12(14)8-10/h1-5,8,10H,6-7H2/t10-/m0/s1 |
| InChIKey |
JHBTUIWZSFFMTR-JTQLQIEISA-N |
| Molecular Weight |
205.213 g/mol |
| SMILES |
C1=[N+](CC[C@@]1(OC(=O)C1=CC=CC=C1)[H])[O-] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971087 |
