CID 10559205

4-formyl-n,n-dimethylbenzamide

Structural Information

Molecular Formula
C10H11NO2
SMILES
CN(C)C(=O)C1=CC=C(C=C1)C=O
InChI
InChI=1S/C10H11NO2/c1-11(2)10(13)9-5-3-8(7-12)4-6-9/h3-7H,1-2H3
InChIKey
RXRYFFTVFMQTKA-UHFFFAOYSA-N
Compound name
4-formyl-N,N-dimethylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

78
Patents

177.07898 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.086256 136.0
[M+Na]+ 200.068198 143.6
[M-H]- 176.071704 141.4
[M+NH4]+ 195.112803 156.6
[M+K]+ 216.042138 143.2
[M+H-H2O]+ 160.076240 129.9
[M+HCOO]- 222.077181 161.7
[M+CH3COO]- 236.092831 186.3
[M+Na-2H]- 198.053646 141.4
[M]+ 177.07843142 138.0
[M]- 177.07952858 138.0
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