CID 52814

73941-39-6

Structural Information

Molecular Formula
C14H30N2
SMILES
CCCCN1CCN(C1CCC)CCCC
InChI
InChI=1S/C14H30N2/c1-4-7-10-15-12-13-16(11-8-5-2)14(15)9-6-3/h14H,4-13H2,1-3H3
InChIKey
RBNKKZKDADUEQJ-UHFFFAOYSA-N
Compound name
1,3-dibutyl-2-propylimidazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.2409 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.24818 160.9
[M+Na]+ 249.23012 165.9
[M-H]- 225.23362 160.4
[M+NH4]+ 244.27472 178.7
[M+K]+ 265.20406 163.4
[M+H-H2O]+ 209.23816 153.1
[M+HCOO]- 271.23910 178.9
[M+CH3COO]- 285.25475 195.0
[M+Na-2H]- 247.21557 160.5
[M]+ 226.24035 162.2
[M]- 226.24145 162.2
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.