| SpectraBase Spectrum ID |
BWnWezNDA7y |
| Name |
Sulfoximinium, N,N,S-trimethyl-S-(2-oxo-4-phenyl-3-butenyl)-, hydroxide, inner salt, (E)- |
| Alternate Name(s) |
(3E)-N,N,S-trimethyl-2-oxo-4-phenylbut-3-ene-1-sulfinamide
(Dimethylamino)methyloxosulfonium[(E)-1-oxo-3-phenyl-2-propenyl]methylide |
| CAS Registry Number |
114274-73-6 |
| Comments |
Note: The molecular formula of the structure shown is C13H19NO2S - which differs from the formula reported for the mass spectrum (C13H17NO2S) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H17NO2S |
| InChI |
InChI=1S/C13H17NO2S/c1-14(2)17(3,16)11-13(15)10-9-12-7-5-4-6-8-12/h4-11H,1-3H3/b10-9+ |
| InChIKey |
RKBROANSQCUJRC-MDZDMXLPSA-N |
| Molecular Weight |
251.344 g/mol |
| SMILES |
[CH-]([S+](N(C)C)(=O)C)C(\C=C\c1ccccc1)=O |
| SPLASH |
splash10-00lu-0900000000-879cf510d4f2d20ff063 |
| Source of Spectrum |
J-53-2633-3 |
| Wiley ID |
1254446 |
