CID 59299306

1-(4-hydroxycyclohexyl)pyrrolidin-2-one

Structural Information

Molecular Formula
C10H17NO2
SMILES
C1CC(=O)N(C1)C2CCC(CC2)O
InChI
InChI=1S/C10H17NO2/c12-9-5-3-8(4-6-9)11-7-1-2-10(11)13/h8-9,12H,1-7H2
InChIKey
JQQONDVCJKOBDE-UHFFFAOYSA-N
Compound name
1-(4-hydroxycyclohexyl)pyrrolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

183.12593 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.13321 142.2
[M+Na]+ 206.11515 146.9
[M-H]- 182.11865 145.2
[M+NH4]+ 201.15975 161.5
[M+K]+ 222.08909 144.7
[M+H-H2O]+ 166.12319 135.6
[M+HCOO]- 228.12413 159.2
[M+CH3COO]- 242.13978 177.2
[M+Na-2H]- 204.10060 142.9
[M]+ 183.12538 135.0
[M]- 183.12648 135.0
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