CID 61484

N-(2-ethylhexyl)aniline

Structural Information

Molecular Formula
C14H23N
SMILES
CCCCC(CC)CNC1=CC=CC=C1
InChI
InChI=1S/C14H23N/c1-3-5-9-13(4-2)12-15-14-10-7-6-8-11-14/h6-8,10-11,13,15H,3-5,9,12H2,1-2H3
InChIKey
GXFHZISVUPJOCI-UHFFFAOYSA-N
Compound name
N-(2-ethylhexyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

205.18304 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.19032 151.6
[M+Na]+ 228.17226 162.9
[M+NH4]+ 223.21686 160.4
[M+K]+ 244.14620 154.8
[M-H]- 204.17576 154.9
[M+Na-2H]- 226.15771 158.4
[M]+ 205.18249 154.1
[M]- 205.18359 154.1
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

patents stripe