| SpectraBase Spectrum ID |
3Mug1Wlzo8 |
| Name |
(1S,2S,9S,10S)-[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-/m0/s1 |
| InChIKey |
LCPYIRCAZAILNB-KDPXUXBGSA-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-0090000000-4c0350c4314930715b55 |
| Source of Spectrum |
KC-0-94-2 |
| Wiley ID |
820934 |
![(1S,2S,9S,10S)-[2H4][2.2](2,5)pyrazinophane](/api/spectrum/3Mug1Wlzo8/structure.png?h=300&w=458 "(1S,2S,9S,10S)-[2H4][2.2](2,5)pyrazinophane")
