CID 9578360

L.m. 2011

Structural Information

Molecular Formula
C7H17N2O
SMILES
C/C=N/OCC[N+](C)(C)C
InChI
InChI=1S/C7H17N2O/c1-5-8-10-7-6-9(2,3)4/h5H,6-7H2,1-4H3/q+1/b8-5+
InChIKey
PMWGASBVKRPNBM-VMPITWQZSA-N
Compound name
2-[(E)-ethylideneamino]oxyethyl-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.1341 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.14138 128.6
[M+Na]+ 168.12332 135.4
[M-H]- 144.12682 132.1
[M+NH4]+ 163.16792 151.2
[M+K]+ 184.09726 131.3
[M+H-H2O]+ 128.13136 126.5
[M+HCOO]- 190.13230 155.6
[M+CH3COO]- 204.14795 179.3
[M+Na-2H]- 166.10877 139.9
[M]+ 145.13355 131.0
[M]- 145.13465 131.0
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.