| SpectraBase Spectrum ID |
6mZzM3eRYx1 |
| Name |
1-Isothiocyanato-2-non-2-enyl-benzene |
| Appearance |
Pale yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
259.139470854 u |
| Formula |
C16H21NS |
| InChI |
InChI=1S/C16H21NS/c1-2-3-4-5-6-7-8-11-15-12-9-10-13-16(15)17-14-18/h7-10,12-13H,2-6,11H2,1H3 |
| InChIKey |
FFDZXQKPEZTONG-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT95Q or Finnigan MAT90 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201706609 |
| Molecular Weight |
259.411 g/mol |
| Quality |
287 |
| Reported Formula |
C16H20NS |
| SMILES |
C1(N=C=S)=C(C=CC=C1)CC=CCCCCCC |
| SPLASH |
splash10-08fs-0920000000-dc8b53ba659d15d84944 |
| Source of Spectrum |
ACI-56-SM23-7j (DOI: 10.1002/anie.201706609) |
| Wiley ID |
1896407 |
