CID 6366149

Brn 5760180

Structural Information

Molecular Formula
C27H27N
SMILES
CC1=C(CCN(C1C2=CC=CC=C2)C/C=C/C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C27H27N/c1-22-26(24-15-7-3-8-16-24)19-21-28(27(22)25-17-9-4-10-18-25)20-11-14-23-12-5-2-6-13-23/h2-18,27H,19-21H2,1H3/b14-11+
InChIKey
CCDVZOIKXIOKFM-SDNWHVSQSA-N
Compound name
5-methyl-4,6-diphenyl-1-[(E)-3-phenylprop-2-enyl]-3,6-dihydro-2H-pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.21436 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.22164 193.8
[M+Na]+ 388.20358 198.2
[M-H]- 364.20708 203.3
[M+NH4]+ 383.24818 203.6
[M+K]+ 404.17752 189.5
[M+H-H2O]+ 348.21162 181.4
[M+HCOO]- 410.21256 211.8
[M+CH3COO]- 424.22821 202.1
[M+Na-2H]- 386.18903 195.1
[M]+ 365.21381 189.3
[M]- 365.21491 189.3
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.