CID 215270

2-benzofurancarbonitrile, 4-methoxy-

Structural Information

Molecular Formula
C10H7NO2
SMILES
COC1=CC=CC2=C1C=C(O2)C#N
InChI
InChI=1S/C10H7NO2/c1-12-9-3-2-4-10-8(9)5-7(6-11)13-10/h2-5H,1H3
InChIKey
BIHPNWHPANRXIG-UHFFFAOYSA-N
Compound name
4-methoxy-1-benzofuran-2-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

173.04768 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.054956 134.3
[M+Na]+ 196.036898 147.9
[M-H]- 172.040404 139.4
[M+NH4]+ 191.081503 154.5
[M+K]+ 212.010838 144.4
[M+H-H2O]+ 156.044940 122.4
[M+HCOO]- 218.045881 156.3
[M+CH3COO]- 232.061531 191.4
[M+Na-2H]- 194.022346 142.3
[M]+ 173.04713142 134.1
[M]- 173.04822858 134.1
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

patents stripe