| SpectraBase Spectrum ID |
IWn4DtRChxk |
| Name |
3',4a',6',8'-tetra(t-butyl)-4a',10a'-dihydrospiro[4H-3,1-benzoxathiine-2,1'(2'H)-dibenzodioxin]-2'-one |
| CAS Registry Number |
124921-75-1 |
| Comments |
Removed - expert review: contamination (chloroform)) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C35H46O4S |
| InChI |
InChI=1S/C35H46O4S/c1-30(2,3)22-17-23(31(4,5)6)27-25(18-22)38-29-34(39-27,33(10,11)12)19-24(32(7,8)9)28(36)35(29)37-20-21-15-13-14-16-26(21)40-35/h13-19,29H,20H2,1-12H3 |
| InChIKey |
OEPPVYPQXVTXIF-UHFFFAOYSA-N |
| Molecular Weight |
562.809 g/mol |
| SMILES |
C12(C3C(Oc4c(O3)cc(cc4C(C)(C)C)C(C)(C)C)(C(C)(C)C)C=C(C2=O)C(C)(C)C)Sc2ccccc2CO1 |
| SPLASH |
splash10-0a5i-9300000000-8bd0cf93848e229f0ffd |
| Source of Spectrum |
K-123-1148-7 |
| Synonyms |
3',4'a,6',8'-tetra-tert-butyl-4'a,10'a-dihydro-2'H,4H-spiro[3,1-benzoxathiine-2,1'-oxanthrene]-2'-one |
| Wiley ID |
1406979 |
![3',4A',6'8'-TETRA-TERT.-BUTYL-4A',10A'-DIHYDROSPIRO-[4H-3,1-BENZOXATHIIN-2,1'(2'H)-DIBENZODIOXIN]-2'-ONE](/api/spectrum/IWn4DtRChxk/structure.png?h=300&w=458 "3',4A',6'8'-TETRA-TERT.-BUTYL-4A',10A'-DIHYDROSPIRO-[4H-3,1-BENZOXATHIIN-2,1'(2'H)-DIBENZODIOXIN]-2'-ONE")
