CID 415705

N-(2-oxo-2h-chromen-6-yl)guanidine

Structural Information

Molecular Formula
C10H9N3O2
SMILES
C1=CC2=C(C=CC(=O)O2)C=C1N=C(N)N
InChI
InChI=1S/C10H9N3O2/c11-10(12)13-7-2-3-8-6(5-7)1-4-9(14)15-8/h1-5H,(H4,11,12,13)
InChIKey
OFZKVNIFUSQLMB-UHFFFAOYSA-N
Compound name
2-(2-oxochromen-6-yl)guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

4
Patents

203.06947 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.07675 140.7
[M+Na]+ 226.05869 149.3
[M-H]- 202.06219 147.0
[M+NH4]+ 221.10329 158.9
[M+K]+ 242.03263 147.7
[M+H-H2O]+ 186.06673 133.6
[M+HCOO]- 248.06767 167.0
[M+CH3COO]- 262.08332 193.3
[M+Na-2H]- 224.04414 149.2
[M]+ 203.06892 139.7
[M]- 203.07002 139.7
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.