CID 728718

1-cinnamoyl-1,2,3,4-tetrahydroquinoline

Structural Information

Molecular Formula
C18H17NO
SMILES
C1CC2=CC=CC=C2N(C1)C(=O)/C=C/C3=CC=CC=C3
InChI
InChI=1S/C18H17NO/c20-18(13-12-15-7-2-1-3-8-15)19-14-6-10-16-9-4-5-11-17(16)19/h1-5,7-9,11-13H,6,10,14H2/b13-12+
InChIKey
SFOVHKYYGVAXCU-OUKQBFOZSA-N
Compound name
(E)-1-(3,4-dihydro-2H-quinolin-1-yl)-3-phenylprop-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

0
Patents

263.131 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.13828 162.8
[M+Na]+ 286.12022 177.6
[M+NH4]+ 281.16482 172.0
[M+K]+ 302.09416 168.3
[M-H]- 262.12372 167.7
[M+Na-2H]- 284.10567 171.5
[M]+ 263.13045 166.4
[M]- 263.13155 166.4
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

No patent data available for this compound.