Acetic Acid → HCID 21083669, compound
Reaction equation
[CH3:26][C:27](=[O:28])[OH:29].[c:1]1([CH2:7][C:8](=[O:9])[c:10]2[cH:11][c:12]3[n:13][c:14](-[c:21]4[s:22][cH:23][cH:24][cH:25]4)[c:15](=[O:20])[nH:16][c:17]3[cH:18][cH:19]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][c:10]2[cH:11][c:12]3[n:13][c:14](-[c:21]4[s:22][cH:23][cH:24][cH:25]4)[c:15](=[O:20])[nH:16][c:17]3[cH:18][cH:19]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1Participants
3
Sources & evidence
- ORD record
- ord-e3a1e5e0a7a64405b698d09f4803313f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
Loading…