CID 132342146

2137593-03-2

Structural Information

Molecular Formula
C8H13NO
SMILES
C1CC2(C1)[C@]3(C[C@H]3CO2)N
InChI
InChI=1S/C8H13NO/c9-8-4-6(8)5-10-7(8)2-1-3-7/h6H,1-5,9H2/t6-,8+/m0/s1
InChIKey
FGQZQXVEFMMLHN-POYBYMJQSA-N
Compound name
(1R,5R)-spiro[3-oxabicyclo[3.1.0]hexane-2,1'-cyclobutane]-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

139.09972 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.10700 124.7
[M+Na]+ 162.08894 133.1
[M-H]- 138.09244 132.7
[M+NH4]+ 157.13354 140.4
[M+K]+ 178.06288 135.5
[M+H-H2O]+ 122.09698 117.4
[M+HCOO]- 184.09792 144.2
[M+CH3COO]- 198.11357 180.3
[M+Na-2H]- 160.07439 133.7
[M]+ 139.09917 133.5
[M]- 139.10027 133.5
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.