CID 2835205

121830-51-1

Structural Information

Molecular Formula
C37H35N
SMILES
CC1(CC(C2=C(N1)C=CC(=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C)C6=CC=CC=C6)C
InChI
InChI=1S/C37H35N/c1-35(2)27-36(3,28-16-8-4-9-17-28)33-26-32(24-25-34(33)38-35)37(29-18-10-5-11-19-29,30-20-12-6-13-21-30)31-22-14-7-15-23-31/h4-26,38H,27H2,1-3H3
InChIKey
BSMRWVMKSVNGHN-UHFFFAOYSA-N
Compound name
2,2,4-trimethyl-4-phenyl-6-trityl-1,3-dihydroquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

493.27695 Da
Monoisotopic Mass

10.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 494.28423 231.9
[M+Na]+ 516.26617 236.0
[M-H]- 492.26967 243.2
[M+NH4]+ 511.31077 239.3
[M+K]+ 532.24011 225.9
[M+H-H2O]+ 476.27421 215.6
[M+HCOO]- 538.27515 243.4
[M+CH3COO]- 552.29080 236.8
[M+Na-2H]- 514.25162 234.3
[M]+ 493.27640 225.2
[M]- 493.27750 225.2
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.