CID 56363

92225-17-7

Structural Information

Molecular Formula
C7H15N2O
SMILES
C[N+](C)(CCC#N)CCO
InChI
InChI=1S/C7H15N2O/c1-9(2,6-7-10)5-3-4-8/h10H,3,5-7H2,1-2H3/q+1
InChIKey
YUYADBNAIBKHJS-UHFFFAOYSA-N
Compound name
2-cyanoethyl-(2-hydroxyethyl)-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.11844 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.12572 130.9
[M+Na]+ 166.10766 139.0
[M-H]- 142.11116 132.0
[M+NH4]+ 161.15226 150.3
[M+K]+ 182.08160 134.2
[M+H-H2O]+ 126.11570 122.6
[M+HCOO]- 188.11664 150.3
[M+CH3COO]- 202.13229 185.2
[M+Na-2H]- 164.09311 140.0
[M]+ 143.11789 126.0
[M]- 143.11899 126.0
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.