| SpectraBase Spectrum ID |
hw3RS0Q8gM |
| Name |
N-Allyloxycarbonyl-8a-(phenylthio)perhydroisoquinolin-1,6-dione |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H21NO4S |
| InChI |
InChI=1S/C19H21NO4S/c1-2-12-24-18(23)20-11-9-14-13-15(21)8-10-19(14,17(20)22)25-16-6-4-3-5-7-16/h2-7,14H,1,8-13H2/t14-,19-/m0/s1 |
| InChIKey |
LGKLDWWVNWYPAD-LIRRHRJNSA-N |
| Molecular Weight |
359.440 g/mol |
| SMILES |
C1(N(CC[C@]2(CC(CC[C@@]12Sc1ccccc1)=O)[H])C(=O)OCC=C)=O |
| SPLASH |
splash10-0002-0903000000-eb6b3a922cddf25764ad |
| Source of Spectrum |
H1-39-291-6 |
| Synonyms |
(4aS,8aS)-1,6-Dioxo-8a-phenylsulfanyl-octahydro-isoquinoline-2-carboxylic acid allyl ester
allyl 1,6-dioxo-8a-(phenylsulfanyl)octahydro-2(1H)-isoquinolinecarboxylate |
| Wiley ID |
756794 |
