CID 92363

N-(2,4-dimethylphenyl)formamide

Structural Information

Molecular Formula
C9H11NO
SMILES
CC1=CC(=C(C=C1)NC=O)C
InChI
InChI=1S/C9H11NO/c1-7-3-4-9(10-6-11)8(2)5-7/h3-6H,1-2H3,(H,10,11)
InChIKey
JOFDPSBOUCXJCC-UHFFFAOYSA-N
Compound name
N-(2,4-dimethylphenyl)formamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

3
References

181
Patents

149.08406 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.09134 128.8
[M+Na]+ 172.07328 137.6
[M-H]- 148.07678 133.2
[M+NH4]+ 167.11788 150.4
[M+K]+ 188.04722 135.6
[M+H-H2O]+ 132.08132 123.4
[M+HCOO]- 194.08226 154.9
[M+CH3COO]- 208.09791 179.5
[M+Na-2H]- 170.05873 136.1
[M]+ 149.08351 129.6
[M]- 149.08461 129.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe