| SpectraBase Spectrum ID |
Dhljpbbax9W |
| Name |
1-(1-Adamantyl)-2-cyano-3,5-dinitrobenzene |
| Alternate Name(s) |
2-(1-adamantyl)-4,6-dinitrobenzonitrile
Benzonitrile, 2,4-dinitro-6-tricyclo[3.3.1.1(3,7)]dec-1-yl- |
| CAS Registry Number |
71466-65-4 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H17N3O4 |
| InChI |
InChI=1S/C17H17N3O4/c18-9-14-15(4-13(19(21)22)5-16(14)20(23)24)17-6-10-1-11(7-17)3-12(2-10)8-17/h4-5,10-12H,1-3,6-8H2 |
| InChIKey |
LWYYMMBXPZYSQT-UHFFFAOYSA-N |
| Molecular Weight |
327.340 g/mol |
| SMILES |
C12(c3c(c(N(=O)=O)cc(N(=O)=O)c3)C#N)CC3CC(C1)CC(C2)C3 |
| SPLASH |
splash10-004i-8329000000-4cfd1a5d5ac8750c0167 |
| Source of Spectrum |
KC-1979-472-0 |
| Wiley ID |
1325467 |
