CID 162422460

5-(3-methyloxetan-3-yl)-1h-pyrazol-3-amine

Structural Information

Molecular Formula
C7H11N3O
SMILES
CC1(COC1)C2=CC(=NN2)N
InChI
InChI=1S/C7H11N3O/c1-7(3-11-4-7)5-2-6(8)10-9-5/h2H,3-4H2,1H3,(H3,8,9,10)
InChIKey
LGMUDWOSMYGVTP-UHFFFAOYSA-N
Compound name
5-(3-methyloxetan-3-yl)-1H-pyrazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

153.09021 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.09749 129.5
[M+Na]+ 176.07943 136.3
[M-H]- 152.08293 132.8
[M+NH4]+ 171.12403 142.7
[M+K]+ 192.05337 138.1
[M+H-H2O]+ 136.08747 118.3
[M+HCOO]- 198.08841 149.3
[M+CH3COO]- 212.10406 176.7
[M+Na-2H]- 174.06488 135.8
[M]+ 153.08966 135.3
[M]- 153.09076 135.3
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.