CID 124507520

2173637-87-9

Structural Information

Molecular Formula
C11H16N2O2
SMILES
CO[C@@H]1C[C@@H](NC1)COC2=CN=CC=C2
InChI
InChI=1S/C11H16N2O2/c1-14-11-5-9(13-7-11)8-15-10-3-2-4-12-6-10/h2-4,6,9,11,13H,5,7-8H2,1H3/t9-,11-/m1/s1
InChIKey
NDAXSNWXBNRDOC-MWLCHTKSSA-N
Compound name
3-[[(2R,4R)-4-methoxypyrrolidin-2-yl]methoxy]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.12119 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12847 146.2
[M+Na]+ 231.11041 152.3
[M-H]- 207.11391 148.3
[M+NH4]+ 226.15501 163.1
[M+K]+ 247.08435 149.7
[M+H-H2O]+ 191.11845 137.9
[M+HCOO]- 253.11939 165.8
[M+CH3COO]- 267.13504 181.5
[M+Na-2H]- 229.09586 150.0
[M]+ 208.12064 144.5
[M]- 208.12174 144.5
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.