CID 12835183

1-[(oxiran-2-yl)methyl]cyclopentan-1-ol

Structural Information

Molecular Formula
C8H14O2
SMILES
C1CCC(C1)(CC2CO2)O
InChI
InChI=1S/C8H14O2/c9-8(3-1-2-4-8)5-7-6-10-7/h7,9H,1-6H2
InChIKey
QEUWFBDCPGCTJZ-UHFFFAOYSA-N
Compound name
1-(oxiran-2-ylmethyl)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

142.09938 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.10666 127.9
[M+Na]+ 165.08860 135.9
[M-H]- 141.09210 134.6
[M+NH4]+ 160.13320 146.0
[M+K]+ 181.06254 135.9
[M+H-H2O]+ 125.09664 123.3
[M+HCOO]- 187.09758 148.3
[M+CH3COO]- 201.11323 172.4
[M+Na-2H]- 163.07405 134.7
[M]+ 142.09883 128.6
[M]- 142.09993 128.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe