CID 124709371

Rac-(2r,3r)-2-[1-(propan-2-yl)-1h-pyrazol-5-yl]oxolan-3-amine

Structural Information

Molecular Formula
C10H17N3O
SMILES
CC(C)N1C(=CC=N1)[C@H]2[C@@H](CCO2)N
InChI
InChI=1S/C10H17N3O/c1-7(2)13-9(3-5-12-13)10-8(11)4-6-14-10/h3,5,7-8,10H,4,6,11H2,1-2H3/t8-,10-/m1/s1
InChIKey
JOFRKRVKFQLQIU-PSASIEDQSA-N
Compound name
(2R,3R)-2-(2-propan-2-ylpyrazol-3-yl)oxolan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.13716 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.14444 144.9
[M+Na]+ 218.12638 151.7
[M-H]- 194.12988 149.4
[M+NH4]+ 213.17098 163.4
[M+K]+ 234.10032 151.1
[M+H-H2O]+ 178.13442 137.5
[M+HCOO]- 240.13536 165.4
[M+CH3COO]- 254.15101 185.7
[M+Na-2H]- 216.11183 145.5
[M]+ 195.13661 142.8
[M]- 195.13771 142.8
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.