CID 9834143

102333-75-5

Structural Information

Molecular Formula
C8H9ClN2O
SMILES
C1=CC(=CC=C1C(C(=O)N)N)Cl
InChI
InChI=1S/C8H9ClN2O/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,7H,10H2,(H2,11,12)
InChIKey
KYSWRPGOPMCGMW-UHFFFAOYSA-N
Compound name
2-amino-2-(4-chlorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

54
Patents

184.04034 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.04762 137.7
[M+Na]+ 207.02956 145.3
[M-H]- 183.03306 140.6
[M+NH4]+ 202.07416 157.2
[M+K]+ 223.00350 141.6
[M+H-H2O]+ 167.03760 132.7
[M+HCOO]- 229.03854 157.3
[M+CH3COO]- 243.05419 184.7
[M+Na-2H]- 205.01501 141.0
[M]+ 184.03979 135.6
[M]- 184.04089 135.6
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