CID 703056

108790-79-0

Structural Information

Molecular Formula
C14H22N2O
SMILES
CC12CN3CC(C1=O)(CN(C2)C34CCCC4)C
InChI
InChI=1S/C14H22N2O/c1-12-7-15-9-13(2,11(12)17)10-16(8-12)14(15)5-3-4-6-14/h3-10H2,1-2H3
InChIKey
CBCOTPRGYVAPSP-UHFFFAOYSA-N
Compound name
5,7-dimethylspiro[1,3-diazatricyclo[3.3.1.13,7]decane-2,1'-cyclopentane]-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.17322 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.180496 154.6
[M+Na]+ 257.162438 159.5
[M-H]- 233.165944 150.4
[M+NH4]+ 252.207043 182.2
[M+K]+ 273.136378 154.9
[M+H-H2O]+ 217.170480 145.0
[M+HCOO]- 279.171421 158.9
[M+CH3COO]- 293.187071 163.1
[M+Na-2H]- 255.147886 162.8
[M]+ 234.17267142 153.6
[M]- 234.17376858 153.6
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

No patent data available for this compound.