CID 421396

4-methyl-4-propylmorpholin-4-ium chloride

Structural Information

Molecular Formula
C8H18NO
SMILES
CCC[N+]1(CCOCC1)C
InChI
InChI=1S/C8H18NO/c1-3-4-9(2)5-7-10-8-6-9/h3-8H2,1-2H3/q+1
InChIKey
RZWDVVAASLNVBS-UHFFFAOYSA-N
Compound name
4-methyl-4-propylmorpholin-4-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

290
Patents

144.13884 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.146116 129.7
[M+Na]+ 167.128058 135.3
[M-H]- 143.131564 132.2
[M+NH4]+ 162.172663 150.4
[M+K]+ 183.101998 130.6
[M+H-H2O]+ 127.136100 127.0
[M+HCOO]- 189.137041 147.9
[M+CH3COO]- 203.152691 167.2
[M+Na-2H]- 165.113506 139.9
[M]+ 144.13829142 126.1
[M]- 144.13938858 126.1
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