CID 3068107

Benzenamine, n,n-bis(2-chloroethyl)-4-(tetradecyloxy)-

Structural Information

Molecular Formula
C24H41Cl2NO
SMILES
CCCCCCCCCCCCCCOC1=CC=C(C=C1)N(CCCl)CCCl
InChI
InChI=1S/C24H41Cl2NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-22-28-24-16-14-23(15-17-24)27(20-18-25)21-19-26/h14-17H,2-13,18-22H2,1H3
InChIKey
ZHFCRFLIZTVRLE-UHFFFAOYSA-N
Compound name
N,N-bis(2-chloroethyl)-4-tetradecoxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

429.25653 Da
Monoisotopic Mass

10.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 430.26381 210.2
[M+Na]+ 452.24575 221.2
[M+NH4]+ 447.29035 217.2
[M+K]+ 468.21969 209.5
[M-H]- 428.24925 212.8
[M+Na-2H]- 450.23120 214.0
[M]+ 429.25598 213.1
[M]- 429.25708 213.1
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.