CID 18464561

4-(2-hydroxyethyl)pyrrolidin-2-one

Structural Information

Molecular Formula
C6H11NO2
SMILES
C1C(CNC1=O)CCO
InChI
InChI=1S/C6H11NO2/c8-2-1-5-3-6(9)7-4-5/h5,8H,1-4H2,(H,7,9)
InChIKey
USLIRRDZCYCNQT-UHFFFAOYSA-N
Compound name
4-(2-hydroxyethyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

75
Patents

129.07898 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.08626 127.0
[M+Na]+ 152.06820 133.8
[M-H]- 128.07170 126.2
[M+NH4]+ 147.11280 148.1
[M+K]+ 168.04214 131.8
[M+H-H2O]+ 112.07624 121.7
[M+HCOO]- 174.07718 146.6
[M+CH3COO]- 188.09283 164.7
[M+Na-2H]- 150.05365 130.7
[M]+ 129.07843 122.9
[M]- 129.07953 122.9
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

patents stripe