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]+ 167.11789 134.8
[M+Na]+ 189.09983 142.7
[M-H]- 165.10333 139.1
[M+NH4]+ 184.14443 161.3
[M+K]+ 205.07377 141.5
[M+H-H2O]+ 149.10787 130.3
[M+HCOO]- 211.10881 155.4
[M+CH3COO]- 225.12446 148.5
[M+Na-2H]- 187.08528 138.8
[M]+ 166.11006 132.0
[M]- 166.11116 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.