Hexane → HCID 22351117, compound
Reaction equation
[C:1]([CH2:2][CH2:3][CH3:4])(=[O:5])[c:6]1[cH:7][c:8]2[c:9]([n:10]([CH2:14][CH2:15][O:16][c:17]3[cH:18][cH:19][c:20]([CH2:21][CH:22]([C:23](=[O:24])[O:25][CH3:26])[C:27](=[O:28])[O:29][CH3:30])[cH:31][cH:32]3)[c:11](=[O:13])[s:12]2)[cH:33][cH:34]1.[CH3:35][CH2:36][CH2:37][CH2:38][CH2:39][CH3:40]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:6]1[cH:7][c:8]2[c:9]([n:10]([CH2:14][CH2:15][O:16][c:17]3[cH:18][cH:19][c:20]([CH2:21][CH:22]([C:23](=[O:24])[O:25][CH3:26])[C:27](=[O:28])[O:29][CH3:30])[cH:31][cH:32]3)[c:11](=[O:13])[s:12]2)[cH:33][cH:34]1Participants
3
Sources & evidence
- ORD record
- ord-4264801327b84f509e5beca45a870903
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
Loading…