Mandelic Acid → Mandelate ion

HRID 2131204Notes

Reaction equation

HRID 2131204 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH:7]2[CH2:8][CH2:9][CH:10]([CH:11]1[NH2:12])[CH2:13]2.[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[OH:14][CH:15]([C:16]([O-:17])=[O:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[OH:25][CH:26]([c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1)[C:33]([OH:34])=[O:35]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[CH:6]1[CH:7]2[CH2:8][CH2:9][CH:10]([CH:11]1[NH3+:12])[CH2:13]2.[OH:14][CH:15]([C:16](=[O:17])[O-:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1

Participants

6

Reactant 4

HCID 1292Mandelic AcidHCID 8857Ethyl AcetateHCID 2724644Ethyl 3-aminobicyclo[2.2.1]heptane-2-carboxylateHCID 3839223Mandelate ion

Product 2

HCID 3839223Mandelate ionHCID 73130387HCID 73130387, compound

Sources & evidence

ORD record
ord-7f1b626b0ff24f119daebbe1050de0d4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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