CID 470021

N,n,n'-trimethyl-n'-nonylethylenediamine

Structural Information

Molecular Formula
C14H32N2
SMILES
CCCCCCCCCN(C)CCN(C)C
InChI
InChI=1S/C14H32N2/c1-5-6-7-8-9-10-11-12-16(4)14-13-15(2)3/h5-14H2,1-4H3
InChIKey
MXCOFYHDAGITSL-UHFFFAOYSA-N
Compound name
N,N,N'-trimethyl-N'-nonylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

228.25655 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.26383 164.5
[M+Na]+ 251.24577 167.0
[M-H]- 227.24927 166.1
[M+NH4]+ 246.29037 183.5
[M+K]+ 267.21971 167.3
[M+H-H2O]+ 211.25381 157.2
[M+HCOO]- 273.25475 188.6
[M+CH3COO]- 287.27040 208.2
[M+Na-2H]- 249.23122 166.0
[M]+ 228.25600 169.7
[M]- 228.25710 169.7
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

patents stripe