CID 11414008

Lansiumamide a

Structural Information

Molecular Formula
C17H15NO
SMILES
C1=CC=C(C=C1)/C=C/C(=O)N/C=C\C2=CC=CC=C2
InChI
InChI=1S/C17H15NO/c19-17(12-11-15-7-3-1-4-8-15)18-14-13-16-9-5-2-6-10-16/h1-14H,(H,18,19)/b12-11+,14-13-
InChIKey
DAZFHZLCFLDNPG-WCYNZMGESA-N
Compound name
(E)-3-phenyl-N-[(Z)-2-phenylethenyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

249.11537 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 250.12265 158.5
[M+Na]+ 272.10459 163.8
[M-H]- 248.10809 164.5
[M+NH4]+ 267.14919 174.8
[M+K]+ 288.07853 158.3
[M+H-H2O]+ 232.11263 150.5
[M+HCOO]- 294.11357 182.8
[M+CH3COO]- 308.12922 194.3
[M+Na-2H]- 270.09004 164.1
[M]+ 249.11482 156.3
[M]- 249.11592 156.3
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

patents stripe