CID 65584884

3-oxa-1-azaspiro[4.4]non-1-en-2-amine

Structural Information

Molecular Formula
C7H12N2O
SMILES
C1CCC2(C1)COC(=N2)N
InChI
InChI=1S/C7H12N2O/c8-6-9-7(5-10-6)3-1-2-4-7/h1-5H2,(H2,8,9)
InChIKey
FQCJOCIIZWKDAN-UHFFFAOYSA-N
Compound name
3-oxa-1-azaspiro[4.4]non-1-en-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

140.09496 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.102236 127.3
[M+Na]+ 163.084178 134.4
[M-H]- 139.087684 131.8
[M+NH4]+ 158.128783 151.3
[M+K]+ 179.058118 134.2
[M+H-H2O]+ 123.092220 121.7
[M+HCOO]- 185.093161 149.6
[M+CH3COO]- 199.108811 141.2
[M+Na-2H]- 161.069626 133.0
[M]+ 140.09441142 123.0
[M]- 140.09550858 123.0
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.