SpectraBase Spectrum ID |
9YETfXYKuN1 |
Name |
1-[(2R,5S)-3,6-Dimethoxy-2-propan-2-yl-5-prop-2-enyl-2H-pyrazin-5-yl]ethanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
268.178692638 u |
Formula |
C14H24N2O3 |
InChI |
InChI=1S/C14H24N2O3/c1-7-8-14(10(4)17)13(19-6)15-11(9(2)3)12(16-14)18-5/h7,9-11,17H,1,8H2,2-6H3/t10?,11-,14+/m1/s1 |
InChIKey |
DFBMQHVSFFKUNV-DRKXBUQZSA-N |
Molecular Weight |
268.357 g/mol |
SMILES |
[C@@]1(N=C([C@](N=C1OC)(C(C)C)[H])OC)(C(O)C)CC=C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.832424 |