CID 213112

25517-58-2

Structural Information

Molecular Formula
C9H14N2O
SMILES
C1CC2CC1CC23CN=C(O3)N
InChI
InChI=1S/C9H14N2O/c10-8-11-5-9(12-8)4-6-1-2-7(9)3-6/h6-7H,1-5H2,(H2,10,11)
InChIKey
DVLVOGKWOSOLIT-UHFFFAOYSA-N
Compound name
spiro[4H-1,3-oxazole-5,2'-bicyclo[2.2.1]heptane]-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.11061 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.117886 134.8
[M+Na]+ 189.099828 142.7
[M-H]- 165.103334 139.1
[M+NH4]+ 184.144433 161.3
[M+K]+ 205.073768 141.5
[M+H-H2O]+ 149.107870 130.3
[M+HCOO]- 211.108811 155.4
[M+CH3COO]- 225.124461 148.5
[M+Na-2H]- 187.085276 138.8
[M]+ 166.11006142 132.0
[M]- 166.11115858 132.0
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.