CID 83815127

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

Structural Information

Molecular Formula
C7H12N2O
SMILES
CN1CC(C2(C1=O)CC2)N
InChI
InChI=1S/C7H12N2O/c1-9-4-5(8)7(2-3-7)6(9)10/h5H,2-4,8H2,1H3
InChIKey
OICWYZPVYGAYHB-UHFFFAOYSA-N
Compound name
7-amino-5-methyl-5-azaspiro[2.4]heptan-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.09496 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.102236 130.7
[M+Na]+ 163.084178 141.4
[M-H]- 139.087684 136.1
[M+NH4]+ 158.128783 150.0
[M+K]+ 179.058118 138.8
[M+H-H2O]+ 123.092220 125.7
[M+HCOO]- 185.093161 152.8
[M+CH3COO]- 199.108811 178.2
[M+Na-2H]- 161.069626 135.5
[M]+ 140.09441142 130.4
[M]- 140.09550858 130.4
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.