| SpectraBase Spectrum ID |
INwh1Jb0JnF |
| Name |
3-(4'-Methoxyphenyl)-4-(7a-methyl-3a,6,7,7a-tetrahydro-5H-benzo[d]isoxazol-4-on-3-yl)sydnone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17N3O5 |
| InChI |
InChI=1S/C17H17N3O5/c1-17-9-3-4-12(21)13(17)14(18-25-17)15-16(22)24-19-20(15)10-5-7-11(23-2)8-6-10/h5-8,13H,3-4,9H2,1-2H3 |
| InChIKey |
HUINPAQEEWDRAU-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/jccs.200100169 |
| Molecular Weight |
343.339 g/mol |
| SMILES |
c1([n+](noc1[O-])-c1ccc(cc1)OC)C1=NOC2(C1C(CCC2)=O)C |
| SPLASH |
splash10-004u-9350000000-519b70f2351cd23a6640 |
| Source of Spectrum |
QA-48-1149-6c |
| Synonyms |
3-(4-Methoxyphenyl)-4-(7a-methyl-4-oxo-3a,4,5,6,7,7a-hexahydrobenzo[d]isoxazol-3-yl)-1,2,3-oxadiazol-3-ium-5-olate |
| Wiley ID |
1795511 |
![3-(4'-Methoxyphenyl)-4-(7a-methyl-3a,6,7,7a-tetrahydro-5H-benzo[d]isoxazol-4-on-3-yl)sydnone](/api/spectrum/INwh1Jb0JnF/structure.png?h=300&w=458 "3-(4'-Methoxyphenyl)-4-(7a-methyl-3a,6,7,7a-tetrahydro-5H-benzo[d]isoxazol-4-on-3-yl)sydnone")
