CID 126838259

4-amino-8-oxa-2-azaspiro[4.5]decan-3-one

Structural Information

Molecular Formula
C8H14N2O2
SMILES
C1COCCC12CNC(=O)C2N
InChI
InChI=1S/C8H14N2O2/c9-6-7(11)10-5-8(6)1-3-12-4-2-8/h6H,1-5,9H2,(H,10,11)
InChIKey
AMZZFACXEUCGTI-UHFFFAOYSA-N
Compound name
4-amino-8-oxa-2-azaspiro[4.5]decan-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.10553 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.11281 136.2
[M+Na]+ 193.09475 141.7
[M-H]- 169.09825 138.7
[M+NH4]+ 188.13935 156.5
[M+K]+ 209.06869 140.3
[M+H-H2O]+ 153.10279 130.4
[M+HCOO]- 215.10373 153.3
[M+CH3COO]- 229.11938 174.2
[M+Na-2H]- 191.08020 140.7
[M]+ 170.10498 127.9
[M]- 170.10608 127.9
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.