CID 11971297

1-acetylpyrrolidine-2-ethanol

Structural Information

Molecular Formula
C8H15NO2
SMILES
CC(=O)N1CCCC1CCO
InChI
InChI=1S/C8H15NO2/c1-7(11)9-5-2-3-8(9)4-6-10/h8,10H,2-6H2,1H3
InChIKey
YFIUCVYOKJUGSF-UHFFFAOYSA-N
Compound name
1-[2-(2-hydroxyethyl)pyrrolidin-1-yl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.117556 136.0
[M+Na]+ 180.099498 142.2
[M-H]- 156.103004 136.4
[M+NH4]+ 175.144103 156.7
[M+K]+ 196.073438 141.1
[M+H-H2O]+ 140.107540 130.2
[M+HCOO]- 202.108481 155.5
[M+CH3COO]- 216.124131 173.6
[M+Na-2H]- 178.084946 137.9
[M]+ 157.10973142 133.8
[M]- 157.11082858 133.8
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.