CID 58720

101670-74-0

Structural Information

Molecular Formula
C6H13ClNO
SMILES
C[N+]1(CCCO1)CCCl
InChI
InChI=1S/C6H13ClNO/c1-8(5-3-7)4-2-6-9-8/h2-6H2,1H3/q+1
InChIKey
RCIREBHCXAIKEN-UHFFFAOYSA-N
Compound name
2-(2-chloroethyl)-2-methyl-1,2-oxazolidin-2-ium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.06857 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.07585 126.7
[M+Na]+ 173.05779 134.5
[M-H]- 149.06129 129.1
[M+NH4]+ 168.10239 149.6
[M+K]+ 189.03173 128.2
[M+H-H2O]+ 133.06583 125.1
[M+HCOO]- 195.06677 142.9
[M+CH3COO]- 209.08242 164.9
[M+Na-2H]- 171.04324 136.0
[M]+ 150.06802 125.9
[M]- 150.06912 125.9
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.