| SpectraBase Spectrum ID |
2p4iwSjuMdc |
| Name |
Phenmedipham-A |
| CAS Registry Number |
621-29-4 |
| Classification |
Herbicide artifact |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
133.052763848 u |
| Formula |
C8H7NO |
| InChI |
InChI=1S/C8H7NO/c1-7-3-2-4-8(5-7)9-6-10/h2-5H,1H3 |
| InChIKey |
CPPGZWWUPFWALU-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
133.150 g/mol |
| Nominal Mass |
133 u |
| Quality |
990 |
| Retention Index |
1047 |
| SMILES |
C1(=CC(=CC=C1)C)N=C=O |
| SPLASH |
splash10-001i-4900000000-0e149f22c7ce8df439e4 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Isocyanato-3-methylbenzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011928 |
