CID 36209

Tributylmethylammonium

Structural Information

Molecular Formula
C13H30N
SMILES
CCCC[N+](C)(CCCC)CCCC
InChI
InChI=1S/C13H30N/c1-5-8-11-14(4,12-9-6-2)13-10-7-3/h5-13H2,1-4H3/q+1
InChIKey
HJHUXWBTVVFLQI-UHFFFAOYSA-N
Compound name
tributyl(methyl)azanium
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

41
References

14879
Patents

200.23782 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.24510 151.9
[M+Na]+ 223.22704 156.4
[M-H]- 199.23054 153.0
[M+NH4]+ 218.27164 172.2
[M+K]+ 239.20098 150.1
[M+H-H2O]+ 183.23508 149.5
[M+HCOO]- 245.23602 174.1
[M+CH3COO]- 259.25167 190.1
[M+Na-2H]- 221.21249 159.1
[M]+ 200.23727 154.9
[M]- 200.23837 154.9
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