CID 11147748

2,4-diaminobenzaldehyde

Structural Information

Molecular Formula
C7H8N2O
SMILES
C1=CC(=C(C=C1N)N)C=O
InChI
InChI=1S/C7H8N2O/c8-6-2-1-5(4-10)7(9)3-6/h1-4H,8-9H2
InChIKey
VMFJRVFZHAPENO-UHFFFAOYSA-N
Compound name
2,4-diaminobenzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

194
Patents

136.06366 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.07094 125.5
[M+Na]+ 159.05288 137.0
[M+NH4]+ 154.09748 133.9
[M+K]+ 175.02682 131.5
[M-H]- 135.05638 128.4
[M+Na-2H]- 157.03833 132.2
[M]+ 136.06311 127.7
[M]- 136.06421 127.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe