CID 3018962

80822-78-2

Structural Information

Molecular Formula
C23H28N2O
SMILES
CCN1CCCC2=C1C=CC(=C2)C(=O)C3=CC4=C(C=C3)N(CCC4)CC
InChI
InChI=1S/C23H28N2O/c1-3-24-13-5-7-17-15-19(9-11-21(17)24)23(26)20-10-12-22-18(16-20)8-6-14-25(22)4-2/h9-12,15-16H,3-8,13-14H2,1-2H3
InChIKey
SXTAHUUIDOMSPN-UHFFFAOYSA-N
Compound name
bis(1-ethyl-3,4-dihydro-2H-quinolin-6-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

34
Patents

348.22015 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.227426 188.3
[M+Na]+ 371.209368 192.9
[M-H]- 347.212874 192.1
[M+NH4]+ 366.253973 200.1
[M+K]+ 387.183308 186.2
[M+H-H2O]+ 331.217410 177.1
[M+HCOO]- 393.218351 199.6
[M+CH3COO]- 407.234001 195.9
[M+Na-2H]- 369.194816 189.2
[M]+ 348.21960142 184.3
[M]- 348.22069858 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