CID 93681187

2126144-87-2

Structural Information

Molecular Formula
C10H17N3O
SMILES
CC1=C(N=C(N1)[C@@H]2C[C@H](CN2)OC)C
InChI
InChI=1S/C10H17N3O/c1-6-7(2)13-10(12-6)9-4-8(14-3)5-11-9/h8-9,11H,4-5H2,1-3H3,(H,12,13)/t8-,9+/m1/s1
InChIKey
FKFLQBWAWUQGOW-BDAKNGLRSA-N
Compound name
2-[(2S,4R)-4-methoxypyrrolidin-2-yl]-4,5-dimethyl-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.13716 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.144436 145.9
[M+Na]+ 218.126378 153.8
[M-H]- 194.129884 146.4
[M+NH4]+ 213.170983 163.8
[M+K]+ 234.100318 150.5
[M+H-H2O]+ 178.134420 138.3
[M+HCOO]- 240.135361 163.5
[M+CH3COO]- 254.151011 179.6
[M+Na-2H]- 216.111826 145.5
[M]+ 195.13661142 142.7
[M]- 195.13770858 142.7
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.