CID 5706781

Dtxsid60430541

Structural Information

Molecular Formula
C8H8ClNO2
SMILES
COC1=CC=C(C=C1)/C(=N\O)/Cl
InChI
InChI=1S/C8H8ClNO2/c1-12-7-4-2-6(3-5-7)8(9)10-11/h2-5,11H,1H3/b10-8+
InChIKey
RWYJLUIRTJBSDS-CSKARUKUSA-N
Compound name
(1E)-N-hydroxy-4-methoxybenzenecarboximidoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

185.02435 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.03163 134.7
[M+Na]+ 208.01357 143.5
[M-H]- 184.01707 138.7
[M+NH4]+ 203.05817 155.3
[M+K]+ 223.98751 140.6
[M+H-H2O]+ 168.02161 129.9
[M+HCOO]- 230.02255 155.8
[M+CH3COO]- 244.03820 181.4
[M+Na-2H]- 205.99902 141.4
[M]+ 185.02380 137.4
[M]- 185.02490 137.4
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.