| SpectraBase Spectrum ID |
8Ik9uLueUnC |
| Name |
8a-(Phenylthio)perhydroisoquinolin-1,6-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H17NO2S |
| InChI |
InChI=1S/C15H17NO2S/c17-12-6-8-15(19-13-4-2-1-3-5-13)11(10-12)7-9-16-14(15)18/h1-5,11H,6-10H2,(H,16,18)/t11-,15-/m0/s1 |
| InChIKey |
XIWJUAVUVAQJII-NHYWBVRUSA-N |
| Molecular Weight |
275.366 g/mol |
| SMILES |
N1CC[C@@]2([C@](C1=O)(CCC(C2)=O)Sc1ccccc1)[H] |
| SPLASH |
splash10-014i-0930000000-5200ffa10f63eedd72c5 |
| Source of Spectrum |
H1-39-290-6 |
| Synonyms |
(4aS,8aS)-8a-Phenylsulfanyl-hexahydro-isoquinoline-1,6-dione
8a-(phenylsulfanyl)hexahydro-1,6(2H,5H)-isoquinolinedione |
| Wiley ID |
756795 |
