CID 10197700

1-(3-hydroxypyrrolidin-1-yl)ethanone

Structural Information

Molecular Formula
C6H11NO2
SMILES
CC(=O)N1CCC(C1)O
InChI
InChI=1S/C6H11NO2/c1-5(8)7-3-2-6(9)4-7/h6,9H,2-4H2,1H3
InChIKey
ODHQVFPGHQBQSY-UHFFFAOYSA-N
Compound name
1-(3-hydroxypyrrolidin-1-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

404
Patents

129.07898 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.086256 126.7
[M+Na]+ 152.068198 133.8
[M-H]- 128.071704 127.6
[M+NH4]+ 147.112803 148.6
[M+K]+ 168.042138 133.3
[M+H-H2O]+ 112.076240 121.4
[M+HCOO]- 174.077181 146.9
[M+CH3COO]- 188.092831 167.5
[M+Na-2H]- 150.053646 129.7
[M]+ 129.07843142 123.8
[M]- 129.07952858 123.8
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

patents stripe