| SpectraBase Spectrum ID |
GIVExkzwr3I |
| Name |
endo-[4aS*,5R*,8S*,8aR*,(S)S*]-5,8-Methano-2(p-nitrophenylsulfinyl)-4a,5,8,8a-tetrahydro-1,4-naphthoquinone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H13NO5S |
| InChI |
InChI=1S/C17H13NO5S/c19-13-8-14(17(20)16-10-2-1-9(7-10)15(13)16)24(23)12-5-3-11(4-6-12)18(21)22/h1-6,8-10,15-16H,7H2/t9-,10+,15+,16+,24?/m1/s1 |
| InChIKey |
JFLAOHVCTWGKMI-TZVBPPOLSA-N |
| Molecular Weight |
343.353 g/mol |
| SMILES |
C=1(C([C@]2([C@]3(C=C[C@@]([C@]2(C(C1)=O)[H])(C3)[H])[H])[H])=O)S(c1ccc(N(=O)=O)cc1)=O |
| SPLASH |
splash10-014i-9501000000-542b048020c99c8db392 |
| Source of Spectrum |
J-65-458-8 |
| Synonyms |
4-[(4-nitrophenyl)sulfinyl]tricyclo[6.2.1.0(2,7)]undeca-4,9-diene-3,6-dione |
| Wiley ID |
1532036 |
![endo-[4aS*,5R*,8S*,8aR*,(S)S*]-5,8-Methano-2(p-nitrophenylsulfinyl)-4a,5,8,8a-tetrahydro-1,4-naphthoquinone](/api/spectrum/GIVExkzwr3I/structure.png?h=300&w=458 "endo-[4aS*,5R*,8S*,8aR*,(S)S*]-5,8-Methano-2(p-nitrophenylsulfinyl)-4a,5,8,8a-tetrahydro-1,4-naphthoquinone")
