CID 13377311

3-cyclohexyl-1,2-oxazol-5-amine

Structural Information

Molecular Formula
C9H14N2O
SMILES
C1CCC(CC1)C2=NOC(=C2)N
InChI
InChI=1S/C9H14N2O/c10-9-6-8(11-12-9)7-4-2-1-3-5-7/h6-7H,1-5,10H2
InChIKey
VQZCMFOELVYEHV-UHFFFAOYSA-N
Compound name
3-cyclohexyl-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

166.11061 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.11789 135.2
[M+Na]+ 189.09983 141.0
[M-H]- 165.10333 140.2
[M+NH4]+ 184.14443 154.1
[M+K]+ 205.07377 140.0
[M+H-H2O]+ 149.10787 128.0
[M+HCOO]- 211.10881 156.1
[M+CH3COO]- 225.12446 148.0
[M+Na-2H]- 187.08528 139.9
[M]+ 166.11006 130.2
[M]- 166.11116 130.2
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