| SpectraBase Spectrum ID |
LoV8WZ5hubq |
| Name |
(2S,5R)-2,5-Dihydro-3,6-dimethoxy-2-isopropyl-5-( 3'-phenyl-2'-propyn-1'-yl)pyrazine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.168127954 u |
| Formula |
C18H22N2O2 |
| InChI |
InChI=1S/C18H22N2O2/c1-13(2)16-18(22-4)19-15(17(20-16)21-3)12-8-11-14-9-6-5-7-10-14/h5-7,9-10,13,15-16H,12H2,1-4H3/t15-,16+/m1/s1 |
| InChIKey |
CPQZJFHKBNHHCV-CVEARBPZSA-N |
| SMILES |
C1(=N[C@](C(=N[C@@]1(CC#CC1=CC=CC=C1)[H])OC)(C(C)C)[H])OC |
