CID 312102

93761-90-1

Structural Information

Molecular Formula
C14H22N2O
SMILES
C1CCC(CC1)C2=NNC(=O)C23CCCCC3
InChI
InChI=1S/C14H22N2O/c17-13-14(9-5-2-6-10-14)12(15-16-13)11-7-3-1-4-8-11/h11H,1-10H2,(H,16,17)
InChIKey
QUAQQKMPDYEYDU-UHFFFAOYSA-N
Compound name
1-cyclohexyl-2,3-diazaspiro[4.5]dec-1-en-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.17322 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.180496 158.7
[M+Na]+ 257.162438 161.7
[M-H]- 233.165944 161.6
[M+NH4]+ 252.207043 176.2
[M+K]+ 273.136378 157.5
[M+H-H2O]+ 217.170480 149.7
[M+HCOO]- 279.171421 171.3
[M+CH3COO]- 293.187071 167.7
[M+Na-2H]- 255.147886 159.2
[M]+ 234.17267142 147.1
[M]- 234.17376858 147.1
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.