CID 3049310

2h-pyran-3-aminium, tetrahydro-n,n,n-trimethyl-, iodide

Structural Information

Molecular Formula
C8H18NO
SMILES
C[N+](C)(C)C1CCCOC1
InChI
InChI=1S/C8H18NO/c1-9(2,3)8-5-4-6-10-7-8/h8H,4-7H2,1-3H3/q+1
InChIKey
FIBYWAIQQXFUFS-UHFFFAOYSA-N
Compound name
trimethyl(oxan-3-yl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.13884 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.146116 128.6
[M+Na]+ 167.128058 133.3
[M-H]- 143.131564 133.8
[M+NH4]+ 162.172663 149.1
[M+K]+ 183.101998 129.5
[M+H-H2O]+ 127.136100 126.2
[M+HCOO]- 189.137041 149.0
[M+CH3COO]- 203.152691 172.6
[M+Na-2H]- 165.113506 139.3
[M]+ 144.13829142 124.8
[M]- 144.13938858 124.8
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.