CID 28603779

2-chloro-6-(dimethylamino)benzaldehyde

Structural Information

Molecular Formula
C9H10ClNO
SMILES
CN(C)C1=C(C(=CC=C1)Cl)C=O
InChI
InChI=1S/C9H10ClNO/c1-11(2)9-5-3-4-8(10)7(9)6-12/h3-6H,1-2H3
InChIKey
HWZUGJLCRJPTPE-UHFFFAOYSA-N
Compound name
2-chloro-6-(dimethylamino)benzaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.04509 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.05237 135.2
[M+Na]+ 206.03431 144.9
[M-H]- 182.03781 140.8
[M+NH4]+ 201.07891 156.9
[M+K]+ 222.00825 142.2
[M+H-H2O]+ 166.04235 130.3
[M+HCOO]- 228.04329 157.2
[M+CH3COO]- 242.05894 186.9
[M+Na-2H]- 204.01976 141.1
[M]+ 183.04454 139.2
[M]- 183.04564 139.2
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

No patent data available for this compound.