CID 15335006

2-hexyldecan-1-amine

Structural Information

Molecular Formula
C16H35N
SMILES
CCCCCCCCC(CCCCCC)CN
InChI
InChI=1S/C16H35N/c1-3-5-7-9-10-12-14-16(15-17)13-11-8-6-4-2/h16H,3-15,17H2,1-2H3
InChIKey
HEGUXAZWCQVLPV-UHFFFAOYSA-N
Compound name
2-hexyldecan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

284
Patents

241.27695 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.28423 169.7
[M+Na]+ 264.26617 171.7
[M-H]- 240.26967 167.6
[M+NH4]+ 259.31077 187.0
[M+K]+ 280.24011 168.9
[M+H-H2O]+ 224.27421 163.1
[M+HCOO]- 286.27515 189.6
[M+CH3COO]- 300.29080 202.4
[M+Na-2H]- 262.25162 169.2
[M]+ 241.27640 172.3
[M]- 241.27750 172.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe