CID 137963936

2225137-20-0

Structural Information

Molecular Formula
C9H15N3O
SMILES
C1COCC1C2=CN(N=C2)CCN
InChI
InChI=1S/C9H15N3O/c10-2-3-12-6-9(5-11-12)8-1-4-13-7-8/h5-6,8H,1-4,7,10H2
InChIKey
IVCVUYGTIKYXFG-UHFFFAOYSA-N
Compound name
2-[4-(oxolan-3-yl)pyrazol-1-yl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

181.1215 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.12878 139.0
[M+Na]+ 204.11072 145.5
[M-H]- 180.11422 143.0
[M+NH4]+ 199.15532 157.7
[M+K]+ 220.08466 144.8
[M+H-H2O]+ 164.11876 131.2
[M+HCOO]- 226.11970 160.8
[M+CH3COO]- 240.13535 180.6
[M+Na-2H]- 202.09617 142.0
[M]+ 181.12095 136.8
[M]- 181.12205 136.8
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.