CID 3051526

1,2'-hexamethylenebis(2-methylpyrrolidine)

Structural Information

Molecular Formula
C16H32N2
SMILES
CC1CCCN1CCCCCCC2(CCCN2)C
InChI
InChI=1S/C16H32N2/c1-15-9-7-14-18(15)13-6-4-3-5-10-16(2)11-8-12-17-16/h15,17H,3-14H2,1-2H3
InChIKey
BQGIEBCHMXGLHN-UHFFFAOYSA-N
Compound name
2-methyl-1-[6-(2-methylpyrrolidin-2-yl)hexyl]pyrrolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.25655 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.26383 167.4
[M+Na]+ 275.24577 170.3
[M-H]- 251.24927 168.3
[M+NH4]+ 270.29037 186.4
[M+K]+ 291.21971 166.6
[M+H-H2O]+ 235.25381 159.5
[M+HCOO]- 297.25475 182.8
[M+CH3COO]- 311.27040 193.2
[M+Na-2H]- 273.23122 165.1
[M]+ 252.25600 162.8
[M]- 252.25710 162.8
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.