CID 111481

2-furanaminium, tetrahydro-n,n-dimethyl-n-(oxiranylmethyl)-, chloride

Structural Information

Molecular Formula
C9H18NO2
SMILES
C[N+](C)(CC1CO1)C2CCCO2
InChI
InChI=1S/C9H18NO2/c1-10(2,6-8-7-12-8)9-4-3-5-11-9/h8-9H,3-7H2,1-2H3/q+1
InChIKey
CXDVEWASIPKGDK-UHFFFAOYSA-N
Compound name
dimethyl-(oxiran-2-ylmethyl)-(oxolan-2-yl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.13376 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.14104 135.9
[M+Na]+ 195.12298 148.8
[M+NH4]+ 190.16758 146.3
[M+K]+ 211.09692 147.9
[M-H]- 171.12648 149.6
[M+Na-2H]- 193.10843 144.4
[M]+ 172.13321 143.1
[M]- 172.13431 143.1
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

No patent data available for this compound.