CID 10931440

7-amino-5-azaspiro[2.4]heptan-4-one

Structural Information

Molecular Formula
C6H10N2O
SMILES
C1CC12C(CNC2=O)N
InChI
InChI=1S/C6H10N2O/c7-4-3-8-5(9)6(4)1-2-6/h4H,1-3,7H2,(H,8,9)
InChIKey
JUQKPJZQWJJXMO-UHFFFAOYSA-N
Compound name
7-amino-5-azaspiro[2.4]heptan-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

126.079315 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 127.086591 126.1
[M+Na]+ 149.068533 136.1
[M-H]- 125.072039 130.0
[M+NH4]+ 144.113138 145.0
[M+K]+ 165.042473 132.8
[M+H-H2O]+ 109.076575 121.3
[M+HCOO]- 171.077516 147.2
[M+CH3COO]- 185.093166 171.8
[M+Na-2H]- 147.053981 131.8
[M]+ 126.07876642 123.3
[M]- 126.07986358 123.3
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