CID 94264

2-cyclohexyloxirane

Structural Information

Molecular Formula
C8H14O
SMILES
C1CCC(CC1)C2CO2
InChI
InChI=1S/C8H14O/c1-2-4-7(5-3-1)8-6-9-8/h7-8H,1-6H2
InChIKey
NPRYHWFMGPYJIY-UHFFFAOYSA-N
Compound name
2-cyclohexyloxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1012
Patents

126.10446 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.11174 127.9
[M+Na]+ 149.09368 140.9
[M+NH4]+ 144.13828 138.4
[M+K]+ 165.06762 136.1
[M-H]- 125.09718 139.8
[M+Na-2H]- 147.07913 137.0
[M]+ 126.10391 134.2
[M]- 126.10501 134.2
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