CID 115404

63939-01-5

Structural Information

Molecular Formula
C10H24NO
SMILES
CCCOC(CC)C[N+](C)(C)C
InChI
InChI=1S/C10H24NO/c1-6-8-12-10(7-2)9-11(3,4)5/h10H,6-9H2,1-5H3/q+1
InChIKey
MKXCZXSYODIEQI-UHFFFAOYSA-N
Compound name
trimethyl(2-propoxybutyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.18579 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.19307 141.1
[M+Na]+ 197.17501 146.6
[M-H]- 173.17851 142.8
[M+NH4]+ 192.21961 162.3
[M+K]+ 213.14895 142.0
[M+H-H2O]+ 157.18305 139.2
[M+HCOO]- 219.18399 163.5
[M+CH3COO]- 233.19964 183.5
[M+Na-2H]- 195.16046 148.8
[M]+ 174.18524 143.7
[M]- 174.18634 143.7
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.