| SpectraBase Spectrum ID |
1GXkbo38Kcd |
| Name |
(1R,2S,9S,10R)-[2H4][2.2](2,5)pyrazinophane |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H8D4N4 |
| InChI |
InChI=1S/C12H12N4/c1-2-10-6-16-12(8-15-10)4-3-11-7-13-9(1)5-14-11/h5-8H,1-4H2/i1D,2D,3D,4D/t1-,2+,3-,4+ |
| InChIKey |
LCPYIRCAZAILNB-SEEMKZSVSA-N |
| Molecular Weight |
216.280 g/mol |
| SMILES |
[C@@]1([C@@](c2ncc([C@@]([D])([C@](c3ncc1nc3)([D])[H])[H])nc2)([D])[H])([D])[H] |
| SPLASH |
splash10-014i-0090000000-56c278741cb95c2345a7 |
| Source of Spectrum |
KC-0-94-1 |
| Wiley ID |
820935 |
![(1R,2S,9S,10R)-[2H4][2.2](2,5)pyrazinophane](/api/spectrum/1GXkbo38Kcd/structure.png?h=300&w=458 "(1R,2S,9S,10R)-[2H4][2.2](2,5)pyrazinophane")
