CID 76954

Propylamine, 2-methyl-n-trityl-

Structural Information

Molecular Formula
C23H25N
SMILES
CC(C)CNC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H25N/c1-19(2)18-24-23(20-12-6-3-7-13-20,21-14-8-4-9-15-21)22-16-10-5-11-17-22/h3-17,19,24H,18H2,1-2H3
InChIKey
DPJZYUYVRIVLJB-UHFFFAOYSA-N
Compound name
2-methyl-N-tritylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

29
Patents

315.1987 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.205976 178.0
[M+Na]+ 338.187918 181.2
[M-H]- 314.191424 186.3
[M+NH4]+ 333.232523 191.0
[M+K]+ 354.161858 175.4
[M+H-H2O]+ 298.195960 168.5
[M+HCOO]- 360.196901 198.9
[M+CH3COO]- 374.212551 211.0
[M+Na-2H]- 336.173366 183.6
[M]+ 315.19815142 175.6
[M]- 315.19924858 175.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe