| SpectraBase Spectrum ID |
3IMtbYIxISr |
| Name |
PYRACARBOLID |
| CAS Registry Number |
24691-76-7 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
217.110278725 u |
| Formula |
C13H15NO2 |
| InChI |
InChI=1S/C13H15NO2/c1-10-12(8-5-9-16-10)13(15)14-11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3,(H,14,15) |
| InChIKey |
YPCALTGLHFLNGA-UHFFFAOYSA-N |
| Molecular Weight |
217.268 g/mol |
| Nominal Mass |
217 u |
| Number of Peaks |
69 |
| SMILES |
N(c1ccccc1)C(C=1CCCOC1C)=O |
| SPLASH |
splash10-004i-9710000000-64209c396aff64bbfeb4 |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
6-methyl-N-phenyl-3,4-dihydro-2H-pyran-5-carboxamide |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_4143 |
