CID 37291

Ethylamine, n,n-dimethyl-2-(diphenylmethoxy)-, n-oxide, oxalate

Structural Information

Molecular Formula
C17H22NO2
SMILES
C[N+](C)(CCOC(C1=CC=CC=C1)C2=CC=CC=C2)O
InChI
InChI=1S/C17H22NO2/c1-18(2,19)13-14-20-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17,19H,13-14H2,1-2H3/q+1
InChIKey
NDYVAPDXGGTUPC-UHFFFAOYSA-N
Compound name
2-benzhydryloxyethyl-hydroxy-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.16504 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.17232 164.6
[M+Na]+ 295.15426 168.7
[M-H]- 271.15776 170.8
[M+NH4]+ 290.19886 179.9
[M+K]+ 311.12820 160.3
[M+H-H2O]+ 255.16230 159.5
[M+HCOO]- 317.16324 186.3
[M+CH3COO]- 331.17889 194.4
[M+Na-2H]- 293.13971 173.1
[M]+ 272.16449 164.0
[M]- 272.16559 164.0
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.