InCHi String:
InChI=1S/C8H8O/c1-7-3-2-4-8(5-7)6-9/h2-6H,1H3
canonical and isomeric SMILES: CC1=CC=CC(=C1)C=O
PUBCHEM iupac NAME: PUBCHEM iupac TRADITIONAL NAME: PUBCHEM iupac OPENEYE NAME: PUBCHEM iupac CAS NAME: PUBCHEM iupac SYSTEMATIC NAME3-methylbenzaldehyde
PubChem Substance (SID):
85165332 593968 4917687PubChem Compound (CID):
12105KEGG: Compound ID
T35505_ALDRICHCAS Registry IDs: 620-23-5
PDB Chemical Component n/a
Miscellaneous Databases and IDs:
Sigma-Aldrich T35505_ALDRICH
ChemBank NCIOpen2_001577
ChemSpider 10667802
NMRShiftDB 10024882
ZINC ZINC00896722
UM-BBD c0242
ChemDB 4115536
NIST Chemistry WebBook 1652019946
MMCD cq_04245
MDL MFCD00003374
Reference data were obtained primarily from the PubChem database.
Three dimensional molecular rendering uses Jmol.
