CID 456743

2clphcon2 me2co

Structural Information

Molecular Formula
C10H11ClN2O
SMILES
CC(=NNC(=O)C1=CC=CC=C1Cl)C
InChI
InChI=1S/C10H11ClN2O/c1-7(2)12-13-10(14)8-5-3-4-6-9(8)11/h3-6H,1-2H3,(H,13,14)
InChIKey
MEINLZMLWYRLTL-UHFFFAOYSA-N
Compound name
2-chloro-N-(propan-2-ylideneamino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.05598 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.06326 145.1
[M+Na]+ 233.04520 152.7
[M-H]- 209.04870 150.2
[M+NH4]+ 228.08980 165.0
[M+K]+ 249.01914 149.6
[M+H-H2O]+ 193.05324 139.5
[M+HCOO]- 255.05418 167.0
[M+CH3COO]- 269.06983 192.2
[M+Na-2H]- 231.03065 150.0
[M]+ 210.05543 146.8
[M]- 210.05653 146.8
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.