CID 6448091

80834-70-4

Structural Information

Molecular Formula
C24H26N2O
SMILES
CC1=CC=C(C=C1)C2=CCN(CC2)C/C=C/C3=CC4=C(C=C3)NC(=O)CC4
InChI
InChI=1S/C24H26N2O/c1-18-4-7-20(8-5-18)21-12-15-26(16-13-21)14-2-3-19-6-10-23-22(17-19)9-11-24(27)25-23/h2-8,10,12,17H,9,11,13-16H2,1H3,(H,25,27)/b3-2+
InChIKey
ZACQJHOOQOJVCO-NSCUHMNNSA-N
Compound name
6-[(E)-3-[4-(4-methylphenyl)-3,6-dihydro-2H-pyridin-1-yl]prop-1-enyl]-3,4-dihydro-1H-quinolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

358.2045 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.21178 191.2
[M+Na]+ 381.19372 195.7
[M-H]- 357.19722 196.0
[M+NH4]+ 376.23832 200.7
[M+K]+ 397.16766 186.9
[M+H-H2O]+ 341.20176 179.5
[M+HCOO]- 403.20270 203.5
[M+CH3COO]- 417.21835 198.3
[M+Na-2H]- 379.17917 191.7
[M]+ 358.20395 184.3
[M]- 358.20505 184.3
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

patents stripe