CID 2779667

Furan-3-carboxamidine hydrochloride

Structural Information

Molecular Formula
C5H6N2O
SMILES
C1=COC=C1C(=N)N
InChI
InChI=1S/C5H6N2O/c6-5(7)4-1-2-8-3-4/h1-3H,(H3,6,7)
InChIKey
NPTVCIGQICWSLH-UHFFFAOYSA-N
Compound name
furan-3-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

100
Patents

110.04801 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.05529 119.4
[M+Na]+ 133.03723 126.6
[M-H]- 109.04073 123.5
[M+NH4]+ 128.08183 141.5
[M+K]+ 149.01117 126.6
[M+H-H2O]+ 93.045270 113.8
[M+HCOO]- 155.04621 145.7
[M+CH3COO]- 169.06186 170.2
[M+Na-2H]- 131.02268 126.6
[M]+ 110.04746 116.6
[M]- 110.04856 116.6
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