| SpectraBase Spectrum ID |
9SSh8nXWRaN |
| Name |
Benzene, 1-(3-chloro-4,4-dimethyl-1-pentenyl)-4-nitro-, (E)- |
| CAS Registry Number |
86983-99-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H16ClNO2 |
| InChI |
InChI=1S/C13H16ClNO2/c1-13(2,3)12(14)9-6-10-4-7-11(8-5-10)15(16)17/h4-9,12H,1-3H3/b9-6+ |
| InChIKey |
XXGSPWGGYVDDAN-RMKNXTFCSA-N |
| Molecular Weight |
253.729 g/mol |
| SMILES |
c1(N(=O)=O)ccc(\C=C\C(C(C)(C)C)Cl)cc1 |
| SPLASH |
splash10-0a4i-9100000000-d3cae7311a4266c9af82 |
| Source of Spectrum |
B-36-539-0 |
| Synonyms |
(E)-3-Chloro-4,4-dimethyl-1-p-nitrophenylpent-1-ene
1-[(1E)-3-chloro-4,4-dimethyl-1-pentenyl]-4-nitrobenzene |
| Wiley ID |
1256695 |
