CID 24805

4-ethyl-1-methyloctylamine

Structural Information

Molecular Formula
C11H25N
SMILES
CCCCC(CC)CCC(C)N
InChI
InChI=1S/C11H25N/c1-4-6-7-11(5-2)9-8-10(3)12/h10-11H,4-9,12H2,1-3H3
InChIKey
TYUUCUBAWUQCSY-UHFFFAOYSA-N
Compound name
5-ethylnonan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.1987 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.20598 145.2
[M+Na]+ 194.18792 153.5
[M+NH4]+ 189.23252 152.9
[M+K]+ 210.16186 147.6
[M-H]- 170.19142 145.4
[M+Na-2H]- 192.17337 147.6
[M]+ 171.19815 146.2
[M]- 171.19925 146.2
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.