CID 26153

N-(3,3-diphenylpropyl)-alpha-ethylbenzylamine hydrochloride

Structural Information

Molecular Formula
C24H27N
SMILES
CCC(C1=CC=CC=C1)NCCC(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C24H27N/c1-2-24(22-16-10-5-11-17-22)25-19-18-23(20-12-6-3-7-13-20)21-14-8-4-9-15-21/h3-17,23-25H,2,18-19H2,1H3
InChIKey
DDBPVKNNAHNHAH-UHFFFAOYSA-N
Compound name
3,3-diphenyl-N-(1-phenylpropyl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

329.21436 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.22164 183.2
[M+Na]+ 352.20358 185.1
[M-H]- 328.20708 190.9
[M+NH4]+ 347.24818 195.3
[M+K]+ 368.17752 179.0
[M+H-H2O]+ 312.21162 173.0
[M+HCOO]- 374.21256 204.2
[M+CH3COO]- 388.22821 214.3
[M+Na-2H]- 350.18903 186.2
[M]+ 329.21381 180.8
[M]- 329.21491 180.8
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

patents stripe