CID 602800

Chemdiv2_002319

Structural Information

Molecular Formula
C8H10N2O3
SMILES
COC1=C(C=C(C=C1)C(=NO)N)O
InChI
InChI=1S/C8H10N2O3/c1-13-7-3-2-5(4-6(7)11)8(9)10-12/h2-4,11-12H,1H3,(H2,9,10)
InChIKey
HFPJMJWKZLRGNZ-UHFFFAOYSA-N
Compound name
N',3-dihydroxy-4-methoxybenzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

182.06914 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.07642 137.1
[M+Na]+ 205.05836 146.9
[M+NH4]+ 200.10296 143.8
[M+K]+ 221.03230 143.1
[M-H]- 181.06186 138.4
[M+Na-2H]- 203.04381 142.0
[M]+ 182.06859 138.4
[M]- 182.06969 138.4
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.