| SpectraBase Spectrum ID |
FdBTEsOP2dR |
| Name |
3-(Phenylthio)-5,6,4a,8a-tetrahydro-4a-methyl-naphthalene-1,8(4H,7H)dione |
| CAS Registry Number |
105090-17-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18O2S |
| InChI |
InChI=1S/C17H18O2S/c1-17-9-5-8-14(18)16(17)15(19)10-13(11-17)20-12-6-3-2-4-7-12/h2-4,6-7,10,16H,5,8-9,11H2,1H3 |
| InChIKey |
VXTQVSYFYYKTQV-UHFFFAOYSA-N |
| Molecular Weight |
286.389 g/mol |
| SMILES |
C1(C2C(CCCC2=O)(C)CC(=C1)Sc1ccccc1)=O |
| SPLASH |
splash10-05g0-0970000000-57d025182dfd3195ef24 |
| Source of Spectrum |
J-52-117-20 |
| Synonyms |
4a-methyl-6-(phenylsulfanyl)-3,4,4a,8a-tetrahydro-1,8(2H,5H)-naphthalenedione |
| Wiley ID |
1289962 |
