CID 105578

67763-12-6

Structural Information

Molecular Formula
C8H10N4O
SMILES
C1=CC=C(C(=C1)C=NN=C(N)N)O
InChI
InChI=1S/C8H10N4O/c9-8(10)12-11-5-6-3-1-2-4-7(6)13/h1-5,13H,(H4,9,10,12)
InChIKey
RRWSDYNYJQHNKL-UHFFFAOYSA-N
Compound name
2-[(2-hydroxyphenyl)methylideneamino]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

178.08546 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.09274 135.9
[M+Na]+ 201.07468 142.1
[M-H]- 177.07818 140.3
[M+NH4]+ 196.11928 154.9
[M+K]+ 217.04862 140.4
[M+H-H2O]+ 161.08272 128.7
[M+HCOO]- 223.08366 164.7
[M+CH3COO]- 237.09931 190.7
[M+Na-2H]- 199.06013 142.2
[M]+ 178.08491 131.9
[M]- 178.08601 131.9
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