CID 80275948

5-(1-methylcyclopentyl)-1,2-oxazol-3-amine

Structural Information

Molecular Formula
C9H14N2O
SMILES
CC1(CCCC1)C2=CC(=NO2)N
InChI
InChI=1S/C9H14N2O/c1-9(4-2-3-5-9)7-6-8(10)11-12-7/h6H,2-5H2,1H3,(H2,10,11)
InChIKey
ILUSNFQESIHBKD-UHFFFAOYSA-N
Compound name
5-(1-methylcyclopentyl)-1,2-oxazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.11061 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.117886 133.9
[M+Na]+ 189.099828 141.4
[M-H]- 165.103334 139.7
[M+NH4]+ 184.144433 156.7
[M+K]+ 205.073768 140.8
[M+H-H2O]+ 149.107870 128.1
[M+HCOO]- 211.108811 157.1
[M+CH3COO]- 225.124461 177.4
[M+Na-2H]- 187.085276 138.4
[M]+ 166.11006142 131.5
[M]- 166.11115858 131.5
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.