| SpectraBase Spectrum ID |
4OLq01fAi1J |
| Name |
1-(2,4,4-Tricyano-1,3-butadienyl)-1,3,5-Cycloheptatriene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H9N3 |
| InChI |
InChI=1S/C14H9N3/c15-9-13(8-14(10-16)11-17)7-12-5-3-1-2-4-6-12/h1-5,7-8H,6H2/b13-7- |
| InChIKey |
ONIRGFCSAIPGGI-QPEQYQDCSA-N |
| Molecular Weight |
219.247 g/mol |
| SMILES |
C(C#N)(C#N)=C\C(C#N)=C\C1=CC=CC=CC1 |
| SPLASH |
splash10-014i-0090000000-d515f565c499ee313b3d |
| Source of Spectrum |
AJ-66-280-4 |
| Synonyms |
(3Z)-4-(1,3,5-cycloheptatrien-1-yl)-1,3-butadiene-1,1,3-tricarbonitrile |
| Wiley ID |
771937 |
