CID 221524

N-(2-ethylhexyl)cyclohexanamine

Structural Information

Molecular Formula
C14H29N
SMILES
CCCCC(CC)CNC1CCCCC1
InChI
InChI=1S/C14H29N/c1-3-5-9-13(4-2)12-15-14-10-7-6-8-11-14/h13-15H,3-12H2,1-2H3
InChIKey
AYMDRBYANXGFGR-UHFFFAOYSA-N
Compound name
N-(2-ethylhexyl)cyclohexanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

112
Patents

211.23 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.23728 156.9
[M+Na]+ 234.21922 157.9
[M-H]- 210.22272 158.3
[M+NH4]+ 229.26382 175.0
[M+K]+ 250.19316 155.8
[M+H-H2O]+ 194.22726 150.1
[M+HCOO]- 256.22820 175.4
[M+CH3COO]- 270.24385 193.3
[M+Na-2H]- 232.20467 158.3
[M]+ 211.22945 152.8
[M]- 211.23055 152.8
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