Hexane → Cyclododecanecarboxaldehyde

반응식

[C:21]([O:22][CH2:23][CH3:24])(=[O:25])[CH3:26].[CH3:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20].[CH3:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32].[O:1]1[CH2:2][C:3]12[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14]2>>[O:1]=[CH:2][CH:3]1[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14]1

참가 물질

반응물 3

HCID 8058Hexane2회

HCID 8857Ethyl Acetate

HCID 110198001-Oxaspiro[2.11]tetradecane

생성물 1

HCID 78737Cyclododecanecarboxaldehyde

출처 및 근거

ORD 기록: ord-13f9d176ea57446c863ed3a07c09e70b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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