CID 90905621

5,5-diethylpyrrolidin-3-olhydrochloride

Structural Information

Molecular Formula
C8H17NO
SMILES
CCC1(CC(CN1)O)CC
InChI
InChI=1S/C8H17NO/c1-3-8(4-2)5-7(10)6-9-8/h7,9-10H,3-6H2,1-2H3
InChIKey
IZKUPZDVKOWNCI-UHFFFAOYSA-N
Compound name
5,5-diethylpyrrolidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

143.13101 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.13829 133.2
[M+Na]+ 166.12023 142.2
[M+NH4]+ 161.16483 142.4
[M+K]+ 182.09417 136.8
[M-H]- 142.12373 132.9
[M+Na-2H]- 164.10568 137.6
[M]+ 143.13046 134.2
[M]- 143.13156 134.2
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

patents stripe