| SpectraBase Compound ID | BgMj4ZHm4pN |
|---|---|
| InChI | InChI=1S/C11H8N2O2/c12-6-3-7-13-10(14)8-4-1-2-5-9(8)11(13)15/h1-2,4-5H,3,7H2 |
| InChIKey | LOOWMCWVRNEZLZ-UHFFFAOYSA-N |
| Mol Weight | 200.2 g/mol |
| Molecular Formula | C11H8N2O2 |
| Exact Mass | 200.058578 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3ezY7x2VB7R |
|---|---|
| Name | 1H-Isoindole-2-propanenitrile, 2,3-dihydro-1,3-dioxo- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.058577504 u |
| Formula | C11H8N2O2 |
| InChI | InChI=1S/C11H8N2O2/c12-6-3-7-13-10(14)8-4-1-2-5-9(8)11(13)15/h1-2,4-5H,3,7H2 |
| InChIKey | LOOWMCWVRNEZLZ-UHFFFAOYSA-N |
| Molecular Weight | 200.197 g/mol |
| SMILES | C1=C2C(=CC=C1)C(=O)N(C2=O)CCC#N |