CID 22200

Ditridecylamine

Structural Information

Molecular Formula
C26H55N
SMILES
CCCCCCCCCCCCCNCCCCCCCCCCCCC
InChI
InChI=1S/C26H55N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-26-24-22-20-18-16-14-12-10-8-6-4-2/h27H,3-26H2,1-2H3
InChIKey
PZFYOFFTIYJCEW-UHFFFAOYSA-N
Compound name
N-tridecyltridecan-1-amine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

2676
Patents

381.43344 Da
Monoisotopic Mass

12.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.44072 211.7
[M+Na]+ 404.42266 209.6
[M-H]- 380.42616 207.9
[M+NH4]+ 399.46726 223.5
[M+K]+ 420.39660 204.1
[M+H-H2O]+ 364.43070 203.0
[M+HCOO]- 426.43164 229.8
[M+CH3COO]- 440.44729 232.1
[M+Na-2H]- 402.40811 208.3
[M]+ 381.43289 219.7
[M]- 381.43399 219.7
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