结构:CC(C)(O)C#Cc1ccc(C#N)cc1
HCID2822155

4-(4-cyanophenyl)-2-methyl-3-butyne-2-ol

4-(3-Hydroxy-3-methylbut-1-yn-1-yl)benzonitrile

C12H11NO185.226 g/molCAS 80151-20-8

IDENTITY

结构与身份

标准 SMILES
CC(C)(O)C#Cc1ccc(C#N)cc1
InChIKey
TVANBECCZHGWDQ-UHFFFAOYSA-N
分子式
C12H11NO
平均分子量
185.226 g/mol
单同位素质量
185.08406397
扩展信息尚未完成同步。

REACTIONS

参与反应

10
HRID956008

Validation data from https://doi.org/10.1039/C8SC04228D

作为生成物
HRID 956008 方程式

Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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HRID957520

Validation data from https://doi.org/10.1039/C8SC04228D

作为生成物
HRID 957520 方程式

Validation data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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HRID1145772

Training data from https://doi.org/10.1039/C8SC04228D (7/10)

作为生成物
HRID 1145772 方程式

Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

查看条件与参与物