| SpectraBase Spectrum ID |
26jAjGsOeb6 |
| Name |
Cpd. 4a-2 |
| Alternate Name(s) |
(3S,5S)-1-Amino-2,6,6-tricyano-3,5-diphenyl-4(S / R)-nitrocyclohex-1-ene
1-Amino-2,6,6-tricyano-3,5-diphenyl-4(S / R)-nitrocyclohex-1-ene
(1'S,2'R,3'S)-5'-amino-2'-nitro-2',3'-dihydro-[1,1':3',1''-terphenyl]-4',4',6'(1'H)-tricarbonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H15N5O2 |
| InChI |
InChI=1S/C21H15N5O2/c22-11-16-17(14-7-3-1-4-8-14)19(26(27)28)18(15-9-5-2-6-10-15)21(12-23,13-24)20(16)25/h1-10,17-19H,25H2/t17-,18+,19+/m0/s1 |
| InChIKey |
FMZSTWFOTLWBJZ-IPMKNSEASA-N |
| Molecular Weight |
369.384 g/mol |
| SMILES |
NC1=C(C#N)[C@@]([C@]([C@](C1(C#N)C#N)(c1ccccc1)[H])(N(=O)=O)[H])(c1ccccc1)[H] |
| SPLASH |
splash10-00dl-1393000000-96171dcb0cf83b380d3a |
| Source of Spectrum |
F5-6-3619-4a-2 |
| Wiley ID |
1733686 |
