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benzaldehyde; 1-ethynyl-2-methyl-benzene

benzaldehyde; 1-ethynyl-2-methyl-benzene

Systemtic Name:benzaldehyde; 1-ethynyl-2-methyl-benzene
Openeye Name:benzaldehyde; 1-ethynyl-2-methyl-benzene
CAS Name:benzaldehyde; 1-ethynyl-2-methylbenzene
IUPAC Name:benzaldehyde; 1-ethynyl-2-methylbenzene
Traditional Name:benzaldehyde; 1-ethynyl-2-methyl-benzene
Formula: C16H14O
MolecularWeight: 222.28176
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C#C.C1=CC=C(C=C1)C=O


Isomeric SMILES

CC1=CC=CC=C1C#C.C1=CC=C(C=C1)C=O


InChI

InChI=1S/C9H8.C7H6O/c1-3-9-7-5-4-6-8(9)2;8-6-7-4-2-1-3-5-7/h1,4-7H,2H3;1-6H


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