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SMILES: C(C#Cc1c(cccc1)Br)O Canonical SMILES: OCC#Cc1ccccc1Br InChI: InChI=1S/C9H7BrO/c10-9-6-2-1-4-8(9)5-3-7-11/h1-2,4,6,11H,7H2 InChIKey: XKDNOCLQNOYLPM-UHFFFAOYSA-N
CBID:797376 http://www.chembase.cn/molecule-797376.html