CID 162649

Ethamon ds

Structural Information

Molecular Formula
C23H34N4O
SMILES
CC[N+](C)(CC)CN1CCN(C1=O)C[N+](C)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H34N4O/c1-5-26(3,6-2)19-24-17-18-25(23(24)28)20-27(4,21-13-9-7-10-14-21)22-15-11-8-12-16-22/h7-16H,5-6,17-20H2,1-4H3/q+2
InChIKey
CEBYTKYCUVDQPD-UHFFFAOYSA-N
Compound name
diethyl-methyl-[[3-[[methyl(diphenyl)azaniumyl]methyl]-2-oxoimidazolidin-1-yl]methyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

382.27325 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.28053 194.2
[M+Na]+ 405.26247 197.0
[M-H]- 381.26597 203.1
[M+NH4]+ 400.30707 204.9
[M+K]+ 421.23641 182.0
[M+H-H2O]+ 365.27051 188.7
[M+HCOO]- 427.27145 212.8
[M+CH3COO]- 441.28710 216.6
[M+Na-2H]- 403.24792 203.1
[M]+ 382.27270 191.8
[M]- 382.27380 191.8
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.