CID 9588616

Brn 5542999

Structural Information

Molecular Formula
C11H11ClN2O2
SMILES
CCC1=C(OC2=C1C=C(C=C2)Cl)/C(=N/O)/N
InChI
InChI=1S/C11H11ClN2O2/c1-2-7-8-5-6(12)3-4-9(8)16-10(7)11(13)14-15/h3-5,15H,2H2,1H3,(H2,13,14)
InChIKey
KUQWCLPUMREUED-UHFFFAOYSA-N
Compound name
5-chloro-3-ethyl-N'-hydroxy-1-benzofuran-2-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.0509 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.05818 151.5
[M+Na]+ 261.04012 162.3
[M-H]- 237.04362 157.3
[M+NH4]+ 256.08472 171.5
[M+K]+ 277.01406 158.5
[M+H-H2O]+ 221.04816 146.5
[M+HCOO]- 283.04910 172.9
[M+CH3COO]- 297.06475 194.5
[M+Na-2H]- 259.02557 156.8
[M]+ 238.05035 156.0
[M]- 238.05145 156.0
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.