CID 37997

Benzoic acid, 2-(aminoiminomethyl)hydrazide, sulfate (2:1)

Structural Information

Molecular Formula
C8H10N4O
SMILES
C1=CC=C(C(=C1)C(=N)N)C(=O)NN
InChI
InChI=1S/C8H10N4O/c9-7(10)5-3-1-2-4-6(5)8(13)12-11/h1-4H,11H2,(H3,9,10)(H,12,13)
InChIKey
SBCCVLRZUJXMLC-UHFFFAOYSA-N
Compound name
2-(hydrazinecarbonyl)benzenecarboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

178.08546 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.09274 137.1
[M+Na]+ 201.07468 142.5
[M-H]- 177.07818 140.1
[M+NH4]+ 196.11928 155.1
[M+K]+ 217.04862 140.5
[M+H-H2O]+ 161.08272 130.1
[M+HCOO]- 223.08366 163.3
[M+CH3COO]- 237.09931 190.0
[M+Na-2H]- 199.06013 141.5
[M]+ 178.08491 130.6
[M]- 178.08601 130.6
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

No patent data available for this compound.