Molecule

2-methylbenzaldehyde

Chemical Information

11 Related Dataset(s) ⌄

13C nuclear magnetic resonance spectroscopy (13C NMR)

1H nuclear magnetic resonance spectroscopy (1H NMR)

2-Tolualdehyde; ESI-QTOF; MS2; CE: 20; [M+H]+

2-Tolualdehyde; ESI-QTOF; MS2; CE: 40; [M+H]+

correlation spectroscopy (COSY)

distortionless enhancement with polarization transfer (DEPT)

distortionless enhancement with polarization transfer (DEPT)

heteronuclear multiple bond coherence (HMBC)

heteronuclear single quantum coherence (HSQC)

O-METHYLBENZALDEHYDE; EI-B; MS

ORTHO TOLUALDEHYDE; EI-B; MS

Metadata Information

Field	Value
NFDI4Chem Molecule ID	nfdi4chem-mol3395
Source
Alternate Name

Field	Value
No additional information available for this Dataset.

Data-Source Molecule ID	Data-Source
CHEBI:27434	chebi
CHEMBL1487138	chembl
29459723	surechembl
58273	surechembl
10722	pubchem
Q7E5H6W6BG	fdasrs
PD158442	probes_and_drugs
120832	brenda
124473	brenda
13209	brenda
152473	brenda
24508	brenda
3593	brenda
55804	brenda
61232	brenda
HMDB0029636	hmdb
Molport-000-871-244	molport
85648	bindingdb
The data in this table is sourced from UniChem at EBI.