CID 52022

73664-08-1

Structural Information

Molecular Formula
C26H32NO
SMILES
CC[N+](C)(CC)C(CC(C1=CC=CC=C1)(C2=CC=CC=C2)O)C3=CC=CC=C3
InChI
InChI=1S/C26H32NO/c1-4-27(3,5-2)25(22-15-9-6-10-16-22)21-26(28,23-17-11-7-12-18-23)24-19-13-8-14-20-24/h6-20,25,28H,4-5,21H2,1-3H3/q+1
InChIKey
OONIOLKUWOEUPD-UHFFFAOYSA-N
Compound name
diethyl-(3-hydroxy-1,3,3-triphenylpropyl)-methylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

374.24838 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.25566 195.3
[M+Na]+ 397.23760 197.0
[M-H]- 373.24110 203.5
[M+NH4]+ 392.28220 205.8
[M+K]+ 413.21154 186.1
[M+H-H2O]+ 357.24564 188.3
[M+HCOO]- 419.24658 213.1
[M+CH3COO]- 433.26223 215.6
[M+Na-2H]- 395.22305 202.4
[M]+ 374.24783 193.1
[M]- 374.24893 193.1
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.