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]+ 202.180156 150.7
[M+Na]+ 224.162098 154.7
[M-H]- 200.165604 151.5
[M+NH4]+ 219.206703 170.0
[M+K]+ 240.136038 154.4
[M+H-H2O]+ 184.170140 143.7
[M+HCOO]- 246.171081 170.5
[M+CH3COO]- 260.186731 185.7
[M+Na-2H]- 222.147546 152.1
[M]+ 201.17233142 151.9
[M]- 201.17342858 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.