CID 90905621

2703775-01-1

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

2
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 133.3
[M+Na]+ 166.12023 139.9
[M-H]- 142.12373 132.6
[M+NH4]+ 161.16483 156.0
[M+K]+ 182.09417 137.8
[M+H-H2O]+ 126.12827 128.7
[M+HCOO]- 188.12921 151.9
[M+CH3COO]- 202.14486 169.2
[M+Na-2H]- 164.10568 137.2
[M]+ 143.13046 129.4
[M]- 143.13156 129.4
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