| SpectraBase Spectrum ID |
39lZKYSOCeI |
| Name |
(-)-(S)-5-(4-ethyl-3,8,10-trimethyl-2-oxo-1,11-dihydrodipyrrin-9-yl)hexanoic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.209992767 u |
| Formula |
C20H28N2O3 |
| InChI |
InChI=1S/C20H28N2O3/c1-6-15-12(3)20(25)22-17(15)10-16-13(4)19(14(5)21-16)11(2)8-7-9-18(23)24/h10-11,21H,6-9H2,1-5H3,(H,22,25)(H,23,24)/b17-10-/t11-/m0/s1 |
| InChIKey |
MVZNYVWGFSLNGI-MTUBTWAWSA-N |
| Molecular Weight |
344.455 g/mol |
| SMILES |
C=1(NC(C)=C(C1C)[C@](CCCC(=O)O)(C)[H])\C=C\1NC(=O)C(=C1CC)C |
