CID 43167

Brn 1265551

Structural Information

Molecular Formula
C19H30N2O4
SMILES
C1CCN(CC1)CC2CC3(CC(OC3=O)CN4CCCCC4)C(=O)O2
InChI
InChI=1S/C19H30N2O4/c22-17-19(11-15(24-17)13-20-7-3-1-4-8-20)12-16(25-18(19)23)14-21-9-5-2-6-10-21/h15-16H,1-14H2
InChIKey
JBKOKMWDZHOUNO-UHFFFAOYSA-N
Compound name
3,8-bis(piperidin-1-ylmethyl)-2,7-dioxaspiro[4.4]nonane-1,6-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.22055 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.22783 185.8
[M+Na]+ 373.20977 187.1
[M-H]- 349.21327 193.7
[M+NH4]+ 368.25437 197.9
[M+K]+ 389.18371 185.9
[M+H-H2O]+ 333.21781 177.1
[M+HCOO]- 395.21875 194.7
[M+CH3COO]- 409.23440 193.3
[M+Na-2H]- 371.19522 180.7
[M]+ 350.22000 177.4
[M]- 350.22110 177.4
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.