| SpectraBase Spectrum ID |
EgzIn0XegUs |
| Name |
(4R,5R)-5-(1,3-Benzodioxol-5-yl)-4-(1H-1,2,3-benzotriazol-1-yl)cyclohexane-1,3-dione |
| Appearance |
Brown oil |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H15N3O4 |
| InChI |
InChI=1S/C19H15N3O4/c23-12-8-13(11-5-6-17-18(7-11)26-10-25-17)19(16(24)9-12)22-15-4-2-1-3-14(15)20-21-22/h1-7,13,19H,8-10H2/t13-,19-/m1/s1 |
| InChIKey |
FIMRQEHJFHZWKC-BFUOFWGJSA-N |
| Instrument Name |
HP 6890-5973 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0011.b26 |
| Molecular Weight |
349.346 g/mol |
| SMILES |
C1C(=O)CC(=O)[C@@]([C@]1(c1cc2c(cc1)OCO2)[H])([n]1c2c(nn1)cccc2)[H] |
| SPLASH |
splash10-0udm-3490000000-a5943104ba44b5e3123a |
| Source of Spectrum |
ARK-2010-340-10 |
| Wiley ID |
1869966 |
