CID 3783360

1-(3,3-diethoxypropyl)pyrrolidine

Structural Information

Molecular Formula
C11H23NO2
SMILES
CCOC(CCN1CCCC1)OCC
InChI
InChI=1S/C11H23NO2/c1-3-13-11(14-4-2)7-10-12-8-5-6-9-12/h11H,3-10H2,1-2H3
InChIKey
AUAATUPVYCPDKE-UHFFFAOYSA-N
Compound name
1-(3,3-diethoxypropyl)pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

201.17288 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.18016 150.7
[M+Na]+ 224.16210 154.7
[M-H]- 200.16560 151.5
[M+NH4]+ 219.20670 170.0
[M+K]+ 240.13604 154.4
[M+H-H2O]+ 184.17014 143.7
[M+HCOO]- 246.17108 170.5
[M+CH3COO]- 260.18673 185.7
[M+Na-2H]- 222.14755 152.1
[M]+ 201.17233 151.9
[M]- 201.17343 151.9
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.