| SpectraBase Spectrum ID |
DGPnJaBqByy |
| Name |
3-Nitro-4-(phenylthio)hex-3-ene |
| Alternate Name(s) |
(1Z)-1-ethyl-2-nitro-1-butenyl phenyl sulfide
{[(1Z)-1-ethyl-2-nitro-1-butenyl]sulfanyl}benzene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H15NO2S |
| InChI |
InChI=1S/C12H15NO2S/c1-3-11(13(14)15)12(4-2)16-10-8-6-5-7-9-10/h5-9H,3-4H2,1-2H3/b12-11- |
| InChIKey |
VSNNQJXQBWISDC-QXMHVHEDSA-N |
| Molecular Weight |
237.317 g/mol |
| SMILES |
c1(S\C(=C\(N(=O)=O)CC)CC)ccccc1 |
| SPLASH |
splash10-0002-0930000000-236d5328a190d01d7758 |
| Source of Spectrum |
J-59-7382-0 |
| Wiley ID |
1239418 |
