| SpectraBase Spectrum ID |
DNut1AyhEMP |
| Name |
4H-Inden-4-one, 2,3,3a,5,6,7-hexahydro-3a-methyl-1-(phenylthio)- |
| CAS Registry Number |
107053-85-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18OS |
| InChI |
InChI=1S/C16H18OS/c1-16-11-10-14(13(16)8-5-9-15(16)17)18-12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3 |
| InChIKey |
FCMMTWIBUGNFKD-UHFFFAOYSA-N |
| Molecular Weight |
258.379 g/mol |
| SMILES |
C12(C(=C(Sc3ccccc3)CC1)CCCC2=O)C |
| SPLASH |
splash10-0f6t-0900000000-358a0b8c7eb1ade84fb7 |
| Source of Spectrum |
J-52-1283-9 |
| Synonyms |
1-Methyl-7-phenylthio-bicyclo[4.3.0]nonan-6-en-2-one
3a-methyl-1-(phenylsulfanyl)-2,3,3a,5,6,7-hexahydro-4H-inden-4-one |
| Wiley ID |
1262004 |
