| SpectraBase Spectrum ID |
JoCPHDZiBqD |
| Name |
(Trans/cis)-6-methyl-3,6-dihydro-2H-pyridine-1,2-dicarboxylic acid 1-benzyl ester 2-methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.131408092 u |
| Formula |
C16H19NO4 |
| InChI |
InChI=1S/C16H19NO4/c1-12-7-6-10-14(15(18)20-2)17(12)16(19)21-11-13-8-4-3-5-9-13/h3-9,12,14H,10-11H2,1-2H3/t12?,14-/m1/s1 |
| InChIKey |
DCSXGANVVOSLMA-TYZXPVIJSA-N |
| SMILES |
C1[C@](C(OC)=O)(N(C(C=C1)C)C(=O)OCC1=CC=CC=C1)[H] |
