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]+ 141.10224 127.3
[M+Na]+ 163.08418 134.4
[M-H]- 139.08768 131.8
[M+NH4]+ 158.12878 151.3
[M+K]+ 179.05812 134.2
[M+H-H2O]+ 123.09222 121.7
[M+HCOO]- 185.09316 149.6
[M+CH3COO]- 199.10881 141.2
[M+Na-2H]- 161.06963 133.0
[M]+ 140.09441 123.0
[M]- 140.09551 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.