| SpectraBase Spectrum ID |
G33YfPDXlsr |
| Name |
2-Phenyl-2-oxazoline, picrate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
376.065513354 u |
| Formula |
C15H12N4O8 |
| InChI |
InChI=1S/C9H9NO.C6H3N3O7/c1-2-4-8(5-3-1)9-10-6-7-11-9;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h1-5H,6-7H2;1-2,10H |
| InChIKey |
SUHLRSHIZXBABG-UHFFFAOYSA-N |
| Molecular Weight |
376.281 g/mol |
| SMILES |
N(=O)(=O)C=1C(=C(C=C(C1)N(=O)=O)N(=O)=O)O.C1=CC=C(C=C1)C=1OCCN1 |
| Spectrum/Structure Validation Score (Raman) |
0.96584 |
