Acetic Acid → HCID 58313094, compound

HRID 2133828Notes

Reaction equation

HRID 2133828 reaction equation
[C:61](=[O:62])([O-:63])[O-:64].[CH2:39]([N+:40]([CH2:41][CH2:42][CH2:43][CH3:44])([CH2:45][CH2:46][CH2:47][CH3:48])[CH2:49][CH2:50][CH2:51][CH3:52])[CH2:53][CH2:54][CH3:55].[CH2:67]1[O:68][CH2:69][CH2:70][CH2:71]1.[CH3:1][C:2]([Si:3]([CH3:4])([CH3:5])[O:6][CH:7]1[CH2:8][CH2:9][C:10]2([CH2:11][CH:12]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[N:13]([C:15](=[O:16])[O:17][CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:14]2)[CH2:30][CH2:31]1)([CH3:32])[CH3:33].[CH3:34][C:35](=[O:36])[OH:37].[F-:38].[K+:65].[K+:66].[Na+:60].[O-:56][C:57]([OH:58])=[O:59]>>[OH:6][CH:7]1[CH2:8][CH2:9][C:10]2([CH2:11][CH:12]([C:25](=[O:26])[O:27][CH2:28][CH3:29])[N:13]([C:15](=[O:16])[O:17][CH2:18][c:19]3[cH:20][cH:21][cH:22][cH:23][cH:24]3)[CH2:14]2)[CH2:30][CH2:31]1

Participants

10

Reactant 9

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 813Potassium Cation2×HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 28179Fluoride IonHCID 583131673-Ethyl 2-(phenylmethyl) 8-{[(1,1-dimethylethyl)(dimethyl)silyl]oxy}-2-azaspiro[4.5]decane-2,3-dicarboxylate

Product 1

HCID 58313094HCID 58313094, compound

Sources & evidence

ORD record
ord-ace2a048554049b38165ad4f47ad4bd6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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