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

51
Patents

183.12593 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.133206 142.2
[M+Na]+ 206.115148 146.9
[M-H]- 182.118654 145.2
[M+NH4]+ 201.159753 161.5
[M+K]+ 222.089088 144.7
[M+H-H2O]+ 166.123190 135.6
[M+HCOO]- 228.124131 159.2
[M+CH3COO]- 242.139781 177.2
[M+Na-2H]- 204.100596 142.9
[M]+ 183.12538142 135.0
[M]- 183.12647858 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