CID 81179351

2770359-19-6

Structural Information

Molecular Formula
C8H12N4O
SMILES
C1CC(C1)(C(=O)NC2=CNN=C2)N
InChI
InChI=1S/C8H12N4O/c9-8(2-1-3-8)7(13)12-6-4-10-11-5-6/h4-5H,1-3,9H2,(H,10,11)(H,12,13)
InChIKey
DPTVTXZINIKXNW-UHFFFAOYSA-N
Compound name
1-amino-N-(1H-pyrazol-4-yl)cyclobutane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.1011 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.108376 140.9
[M+Na]+ 203.090318 145.0
[M-H]- 179.093824 143.0
[M+NH4]+ 198.134923 153.2
[M+K]+ 219.064258 145.9
[M+H-H2O]+ 163.098360 128.1
[M+HCOO]- 225.099301 161.2
[M+CH3COO]- 239.114951 182.9
[M+Na-2H]- 201.075766 145.5
[M]+ 180.10055142 143.8
[M]- 180.10164858 143.8
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.