CID 9587871

N-(acetylpropylidene)aminoguanidine acetate

Structural Information

Molecular Formula
C6H12N4O
SMILES
CC(=O)CC/C=N/N=C(N)N
InChI
InChI=1S/C6H12N4O/c1-5(11)3-2-4-9-10-6(7)8/h4H,2-3H2,1H3,(H4,7,8,10)/b9-4+
InChIKey
PMRBCRHSYKDPMN-RUDMXATFSA-N
Compound name
2-[(E)-4-oxopentylideneamino]guanidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

156.1011 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.10838 135.3
[M+Na]+ 179.09032 141.1
[M+NH4]+ 174.13492 141.2
[M+K]+ 195.06426 137.5
[M-H]- 155.09382 135.7
[M+Na-2H]- 177.07577 137.6
[M]+ 156.10055 135.4
[M]- 156.10165 135.4
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.