CID 137949022

4-oxaspiro[2.4]heptan-6-amine

Structural Information

Molecular Formula
C6H11NO
SMILES
C1CC12CC(CO2)N
InChI
InChI=1S/C6H11NO/c7-5-3-6(1-2-6)8-4-5/h5H,1-4,7H2
InChIKey
SZEYBIHWBKIRJG-UHFFFAOYSA-N
Compound name
4-oxaspiro[2.4]heptan-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

113.08406 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.09134 124.1
[M+Na]+ 136.07328 135.2
[M+NH4]+ 131.11788 135.5
[M+K]+ 152.04722 131.6
[M-H]- 112.07678 135.0
[M+Na-2H]- 134.05873 132.8
[M]+ 113.08351 129.9
[M]- 113.08461 129.9
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