| SpectraBase Spectrum ID |
BBd1Hxct7Sx |
| Name |
6-Adamantyl-5-chloro-1,4-diazine-2,3-dicarbonitrile |
| Alternate Name(s) |
5-(2-adamantyl)-6-chloro-2,3-pyrazinedicarbonitrile
6-Adamantyl-5-chloro-1,4-diazine-2,3-dicabonitrile
5-(1-adamantyl)-6-chloropyrazine-2,3-dicarbonitrile
5-(1-adamantyl)-6-chloranyl-pyrazine-2,3-dicarbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15ClN4 |
| InChI |
InChI=1S/C16H15ClN4/c17-15-14(20-12(7-18)13(8-19)21-15)16-4-9-1-10(5-16)3-11(2-9)6-16/h9-11H,1-6H2/t9-,10+,11-,16- |
| InChIKey |
ADNPNQYZYDYJBF-XMEMTASGSA-N |
| Molecular Weight |
298.777 g/mol |
| SMILES |
C12(c3nc(C#N)c(nc3Cl)C#N)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H] |
| SPLASH |
splash10-0002-0092000000-bae482b0367f5b726d3a |
| Source of Spectrum |
H1-36-135-10 |
| Wiley ID |
755187 |
