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]+ 225.19614 158.0
[M+Na]+ 247.17808 161.6
[M-H]- 223.18158 158.3
[M+NH4]+ 242.22268 176.6
[M+K]+ 263.15202 159.1
[M+H-H2O]+ 207.18612 151.3
[M+HCOO]- 269.18706 169.9
[M+CH3COO]- 283.20271 184.4
[M+Na-2H]- 245.16353 159.7
[M]+ 224.18831 150.0
[M]- 224.18941 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.