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Molecule record

3-methylbenzaldehyde

C8H8O

120.15 g/mol

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Molecular properties

Formula
C8H8O
Molar mass
120.15 g·mol−1
Exact mass
120.0575 Da
5
PubChem CID
12105

Functional groups

Aldehyde
Alkane / alkyl carbon
Aromatic ring

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 210-632-0
  • 3-Tolylaldehyde
  • 3-methyl-benzaldehyde
  • 3-tolualdehyde
  • 620-23-5
  • Benzaldehyde, 3-methyl-
  • CHEBI:28476
  • DTXCID1043203
Show all 24 synonyms
  • DTXSID6060717
  • FEMA NO. 3068, M-
  • HSDB 7691
  • M-FORMYLTOLUENE
  • M-TOLUALDEHYDE
  • M-Tolualdehyde, stabilized
  • MFCD00003374
  • NSC-1244
  • NSC-89859
  • OWH6650C4Y
  • RefChem:800392
  • bmse000552
  • m-Methylbenzaldehyde
  • m-Toluylaldehyde
  • m-Tolyl aldehyde
  • meta-methylbenzaldehyde

Structure identifiers

Canonical SMILES
Cc1cccc(C=O)c1
Isomeric SMILES
CC1=CC(=CC=C1)C=O
InChI
InChI=1S/C8H8O/c1-7-3-2-4-8(5-7)6-9/h2-6H,1H3
InChIKey
OVWYEQOVUDKZNU-UHFFFAOYSA-N
PubChem CID
12105

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 3-methylbenzaldehyde; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 3-methylbenzaldehyde; not experimental data.

Sources

Molecule identity

Retrieved 8/19/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record