CID 85708970

5-oxa-6-azaspiro[2.4]heptane hydrochloride

Structural Information

Molecular Formula
C5H9NO
SMILES
C1CC12CNOC2
InChI
InChI=1S/C5H9NO/c1-2-5(1)3-6-7-4-5/h6H,1-4H2
InChIKey
JGKSDWOZVQWSLG-UHFFFAOYSA-N
Compound name
5-oxa-6-azaspiro[2.4]heptane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

99.06841 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 100.07569 123.0
[M+Na]+ 122.05763 134.7
[M+NH4]+ 117.10223 134.0
[M+K]+ 138.03157 130.8
[M-H]- 98.061134 132.5
[M+Na-2H]- 120.04308 131.6
[M]+ 99.067861 128.4
[M]- 99.068959 128.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe