CID 12542144

1-(1-hydroxycyclopentyl)propan-1-one

Structural Information

Molecular Formula
C8H14O2
SMILES
CCC(=O)C1(CCCC1)O
InChI
InChI=1S/C8H14O2/c1-2-7(9)8(10)5-3-4-6-8/h10H,2-6H2,1H3
InChIKey
FILYHYAFRCQCRE-UHFFFAOYSA-N
Compound name
1-(1-hydroxycyclopentyl)propan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

142.09938 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.106656 131.8
[M+Na]+ 165.088598 138.0
[M-H]- 141.092104 133.7
[M+NH4]+ 160.133203 156.1
[M+K]+ 181.062538 137.0
[M+H-H2O]+ 125.096640 127.9
[M+HCOO]- 187.097581 152.6
[M+CH3COO]- 201.113231 170.0
[M+Na-2H]- 163.074046 135.7
[M]+ 142.09883142 129.1
[M]- 142.09992858 129.1
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