benzaldehyde; 2,3-dimethylbuta-1,3-diene

Systemtic Name: benzaldehyde; 2,3-dimethylbuta-1,3-diene Openeye Name: benzaldehyde; 2,3-dimethylbuta-1,3-diene CAS Name: benzaldehyde; 2,3-dimethylbuta-1,3-diene IUPAC Name: benzaldehyde; 2,3-dimethylbuta-1,3-diene Traditional Name: benzaldehyde; 2,3-dimethylbuta-1,3-diene Formula: C13H16O MolecularWeight: 188.26554

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(=C)C.C1=CC=C(C=C1)C=O

Isomeric SMILES

CC(=C)C(=C)C.C1=CC=C(C=C1)C=O

InChI

InChI=1S/C7H6O.C6H10/c8-6-7-4-2-1-3-5-7;1-5(2)6(3)4/h1-6H;1,3H2,2,4H3