Systematic / IUPAC Name: 4-(5-Methyl-1,2-oxazol-3-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
ID: Reference8552
Other Names:
2-(5-Methyl-1,2-oxazol-3-yl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione;
4-(5-Methyl-3-isoxazolyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione;
4-(5-Methylisoxazol-3-yl)-4-azatricyclo[5.2.1.0]dec-8-ene-3,5-dione
Formula: C13H12N2O3
4-(5-Methylisoxazol-3-yl)-4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Q Exactive Orbitrap |
No. of Spectral Trees | 1 |
No. of Spectra | 110 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | ESI |
Analyzers | FT |
Last Modification | 2/27/2019 12:43:21 PM |
InChI | InChI=1S/C13H12N2O3/c1-6-4-9(14-18-6)15-12(16)10-7-2-3-8(5-7)11(10)13(15)17/h2-4,7-8,10-11H,5H2,1H3 |
InChI Key | VAACXACXOCSPPL-UHFFFAOYSA-N |
Canonical SMILES | CC1=CC(=NO1)N2C(=O)C3C4CC(C3C2=O)C=C4 |
CAS | |
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Other Names |
2-(5-Methyl-1,2-oxazol-3-yl)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione; 4-(5-Methyl-3-isoxazolyl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione; 4-(5-Methylisoxazol-3-yl)-4-azatricyclo[5.2.1.0]dec-8-ene-3,5-dione |
ChemSpider | 2014102 |
ChEMBL | CHEMBL1869246 |
PubChem | 2732284 |