CID 42956274

N',3-dihydroxybenzene-1-carboximidamide

Structural Information

Molecular Formula
C7H8N2O2
SMILES
C1=CC(=CC(=C1)O)/C(=N/O)/N
InChI
InChI=1S/C7H8N2O2/c8-7(9-11)5-2-1-3-6(10)4-5/h1-4,10-11H,(H2,8,9)
InChIKey
VAKNFLSIQNXPQH-UHFFFAOYSA-N
Compound name
N',3-dihydroxybenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

152.05858 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.06586 129.0
[M+Na]+ 175.04780 136.1
[M-H]- 151.05130 131.3
[M+NH4]+ 170.09240 148.6
[M+K]+ 191.02174 134.2
[M+H-H2O]+ 135.05584 123.2
[M+HCOO]- 197.05678 153.8
[M+CH3COO]- 211.07243 176.4
[M+Na-2H]- 173.03325 135.3
[M]+ 152.05803 125.6
[M]- 152.05913 125.6
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