CID 65179915

2-(chloromethyl)-5-cyclohexyl-1,3-oxazole

Structural Information

Molecular Formula
C10H14ClNO
SMILES
C1CCC(CC1)C2=CN=C(O2)CCl
InChI
InChI=1S/C10H14ClNO/c11-6-10-12-7-9(13-10)8-4-2-1-3-5-8/h7-8H,1-6H2
InChIKey
UVJPZWKBZNEAAX-UHFFFAOYSA-N
Compound name
2-(chloromethyl)-5-cyclohexyl-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.07639 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.08367 141.9
[M+Na]+ 222.06561 154.8
[M+NH4]+ 217.11021 151.5
[M+K]+ 238.03955 149.3
[M-H]- 198.06911 146.6
[M+Na-2H]- 220.05106 148.5
[M]+ 199.07584 145.3
[M]- 199.07694 145.3
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

No patent data available for this compound.