CID 40310

Tetrahydrofurfuryltrimethylammonium iodide

Structural Information

Molecular Formula
C8H18NO
SMILES
C[N+](C)(C)CC1CCCO1
InChI
InChI=1S/C8H18NO/c1-9(2,3)7-8-5-4-6-10-8/h8H,4-7H2,1-3H3/q+1
InChIKey
NHVTWSTVVZJSLJ-UHFFFAOYSA-N
Compound name
trimethyl(oxolan-2-ylmethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

144.13884 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.14612 129.5
[M+Na]+ 167.12806 135.2
[M-H]- 143.13156 134.9
[M+NH4]+ 162.17266 151.9
[M+K]+ 183.10200 131.3
[M+H-H2O]+ 127.13610 127.6
[M+HCOO]- 189.13704 152.1
[M+CH3COO]- 203.15269 172.5
[M+Na-2H]- 165.11351 139.2
[M]+ 144.13829 127.8
[M]- 144.13939 127.8
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.