CID 103079232

1-methyl-3-(oxetan-3-yloxy)-1h-pyrazol-4-amine

Structural Information

Molecular Formula
C7H11N3O2
SMILES
CN1C=C(C(=N1)OC2COC2)N
InChI
InChI=1S/C7H11N3O2/c1-10-2-6(8)7(9-10)12-5-3-11-4-5/h2,5H,3-4,8H2,1H3
InChIKey
FPOFNFMMRWGUGG-UHFFFAOYSA-N
Compound name
1-methyl-3-(oxetan-3-yloxy)pyrazol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.08513 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.09241 130.0
[M+Na]+ 192.07435 136.9
[M-H]- 168.07785 134.5
[M+NH4]+ 187.11895 141.4
[M+K]+ 208.04829 140.1
[M+H-H2O]+ 152.08239 117.5
[M+HCOO]- 214.08333 151.4
[M+CH3COO]- 228.09898 182.8
[M+Na-2H]- 190.05980 135.1
[M]+ 169.08458 139.0
[M]- 169.08568 139.0
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.