CID 6444767

P 244

Structural Information

Molecular Formula
C16H32N2O4
SMILES
C[N+](C)(C)CC1COC(O1)/C=C/C2OCC(O2)C[N+](C)(C)C
InChI
InChI=1S/C16H32N2O4/c1-17(2,3)9-13-11-19-15(21-13)7-8-16-20-12-14(22-16)10-18(4,5)6/h7-8,13-16H,9-12H2,1-6H3/q+2/b8-7+
InChIKey
HNWSUXZORSGSBU-BQYQJAHWSA-N
Compound name
trimethyl-[[2-[(E)-2-[4-[(trimethylazaniumyl)methyl]-1,3-dioxolan-2-yl]ethenyl]-1,3-dioxolan-4-yl]methyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

316.2362 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.24348 171.7
[M+Na]+ 339.22542 182.0
[M+NH4]+ 334.27002 179.9
[M+K]+ 355.19936 184.2
[M-H]- 315.22892 181.8
[M+Na-2H]- 337.21087 174.4
[M]+ 316.23565 176.7
[M]- 316.23675 176.7
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.