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]+ 154.097486 129.5
[M+Na]+ 176.079428 136.3
[M-H]- 152.082934 132.8
[M+NH4]+ 171.124033 142.7
[M+K]+ 192.053368 138.1
[M+H-H2O]+ 136.087470 118.3
[M+HCOO]- 198.088411 149.3
[M+CH3COO]- 212.104061 176.7
[M+Na-2H]- 174.064876 135.8
[M]+ 153.08966142 135.3
[M]- 153.09075858 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.