| SpectraBase Spectrum ID |
1h9UWFwtsXJ |
| Name |
(3,5,6-trimethylpyrazin-2-yl)methyl (2S)-methylbutanoate |
| Appearance |
Pale yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20N2O2 |
| InChI |
InChI=1S/C13H20N2O2/c1-6-8(2)13(16)17-7-12-11(5)14-9(3)10(4)15-12/h8H,6-7H2,1-5H3/t8-/m0/s1 |
| InChIKey |
LDMNOWUFVWOZDR-QMMMGPOBSA-N |
| Instrument Name |
Waters GCT Premier |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1021/np300388y |
| Molecular Weight |
236.315 g/mol |
| Optical Rotation |
[a]20D = +8.7 (c = 0.83, DCM) |
| Reported Formula |
C13H20N2O2 |
| SMILES |
c1(c(nc(c(n1)C)COC([C@](CC)(C)[H])=O)C)C |
| SPLASH |
splash10-0udi-3900000000-cd735551b4d903ffa2b1 |
| Source of Spectrum |
G4-75-1590-3 |
| Wiley ID |
1854840 |
