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Ethanol → HCID 12769816, compound

HRID 663760
Notes
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Reaction equation

HRID 663760 reaction equation
[C:23](=[O:24])([OH:25])[O-:26].[CH2:1]([CH3:2])[O:3][C:4]([CH:5]([CH3:6])[c:7]1[cH:8][cH:9][c:10]2[c:11]([cH:21]1)[C:12](=[O:20])[CH2:13][CH:14]([C:16]([CH3:17])([CH3:18])[CH3:19])[O:15]2)=[O:22].[CH3:29][CH2:30][OH:31].[Na+:27].[OH2:28]>>[O:3]=[C:4]([CH:5]([CH3:6])[c:7]1[cH:8][cH:9][c:10]2[c:11]([cH:21]1)[C:12](=[O:20])[CH2:13][CH:14]([C:16]([CH3:17])([CH3:18])[CH3:19])[O:15]2)[OH:22]
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 702EthanolHCID 769Bicarbonate IonHCID 923Sodium IonHCID 962WaterHCID 54545077Ethyl-2-[2,3-dihydro-2-(1,1-dimethylethyl)-4-oxo-4H-1-benzopyran-6-yl]propionate

Product 1

HCID 12769816HCID 12769816, compound

Sources & evidence

ORD record
ord-537c1be9c8544cf7bf7bbc49a55f9ec1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes