CID 217574

5555-51-1

Structural Information

Molecular Formula
C7H8ClNO
SMILES
C1=CC(=CC=C1CON)Cl
InChI
InChI=1S/C7H8ClNO/c8-7-3-1-6(2-4-7)5-10-9/h1-4H,5,9H2
InChIKey
GONDHKVGJCQJPR-UHFFFAOYSA-N
Compound name
O-[(4-chlorophenyl)methyl]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

191
Patents

157.02943 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.03671 127.5
[M+Na]+ 180.01865 141.1
[M+NH4]+ 175.06325 137.1
[M+K]+ 195.99259 134.0
[M-H]- 156.02215 130.7
[M+Na-2H]- 178.00410 135.6
[M]+ 157.02888 130.6
[M]- 157.02998 130.6
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