CID 22291232

1,8-diazaspiro[4.5]decan-2-one

Structural Information

Molecular Formula
C8H14N2O
SMILES
C1CC2(CCNCC2)NC1=O
InChI
InChI=1S/C8H14N2O/c11-7-1-2-8(10-7)3-5-9-6-4-8/h9H,1-6H2,(H,10,11)
InChIKey
UXPXPVHFEUNLBQ-UHFFFAOYSA-N
Compound name
1,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

156
Patents

154.11061 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.11789 136.1
[M+Na]+ 177.09983 141.1
[M-H]- 153.10333 135.3
[M+NH4]+ 172.14443 156.5
[M+K]+ 193.07377 137.9
[M+H-H2O]+ 137.10787 129.3
[M+HCOO]- 199.10881 150.7
[M+CH3COO]- 213.12446 146.8
[M+Na-2H]- 175.08528 140.1
[M]+ 154.11006 125.6
[M]- 154.11116 125.6
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