CID 88942

21542-96-1

Structural Information

Molecular Formula
C24H51N
SMILES
CCCCCCCCCCCCCCCCCCCCCCN(C)C
InChI
InChI=1S/C24H51N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(2)3/h4-24H2,1-3H3
InChIKey
ICZKASVWFUJTEI-UHFFFAOYSA-N
Compound name
N,N-dimethyldocosan-1-amine
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

1
References

1683
Patents

353.40216 Da
Monoisotopic Mass

11.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 354.409436 204.8
[M+Na]+ 376.391378 203.8
[M-H]- 352.394884 203.0
[M+NH4]+ 371.435983 218.4
[M+K]+ 392.365318 200.1
[M+H-H2O]+ 336.399420 196.3
[M+HCOO]- 398.400361 224.0
[M+CH3COO]- 412.416011 229.7
[M+Na-2H]- 374.376826 201.6
[M]+ 353.40161142 213.4
[M]- 353.40270858 213.4
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