CID 131516355

1-{1,8-diazaspiro[4.5]decan-1-yl}-2,2-dimethylpropan-1-one hydrochloride

Structural Information

Molecular Formula
C13H24N2O
SMILES
CC(C)(C)C(=O)N1CCCC12CCNCC2
InChI
InChI=1S/C13H24N2O/c1-12(2,3)11(16)15-10-4-5-13(15)6-8-14-9-7-13/h14H,4-10H2,1-3H3
InChIKey
HDROXMBCCGEAAN-UHFFFAOYSA-N
Compound name
1-(1,8-diazaspiro[4.5]decan-1-yl)-2,2-dimethylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.18886 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.196136 158.0
[M+Na]+ 247.178078 161.6
[M-H]- 223.181584 158.3
[M+NH4]+ 242.222683 176.6
[M+K]+ 263.152018 159.1
[M+H-H2O]+ 207.186120 151.3
[M+HCOO]- 269.187061 169.9
[M+CH3COO]- 283.202711 184.4
[M+Na-2H]- 245.163526 159.7
[M]+ 224.18831142 150.0
[M]- 224.18940858 150.0
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.