CID 129872

Sk&f 106610

Structural Information

Molecular Formula
C23H44N2
SMILES
CCCC1(CCC2(CC1)CCN(C2)CCCN3CCCCC3)CCC
InChI
InChI=1S/C23H44N2/c1-3-9-22(10-4-2)11-13-23(14-12-22)15-20-25(21-23)19-8-18-24-16-6-5-7-17-24/h3-21H2,1-2H3
InChIKey
FPYDSYNEQOHKET-UHFFFAOYSA-N
Compound name
2-(3-piperidin-1-ylpropyl)-8,8-dipropyl-2-azaspiro[4.5]decane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

13
Patents

348.35046 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.35774 195.5
[M+Na]+ 371.33968 194.6
[M-H]- 347.34318 197.8
[M+NH4]+ 366.38428 211.0
[M+K]+ 387.31362 189.8
[M+H-H2O]+ 331.34772 184.7
[M+HCOO]- 393.34866 204.6
[M+CH3COO]- 407.36431 213.3
[M+Na-2H]- 369.32513 191.5
[M]+ 348.34991 186.7
[M]- 348.35101 186.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe