CID 10355825

3-(1-naphthoyl)indole

Structural Information

Molecular Formula
C19H13NO
SMILES
C1=CC=C2C(=C1)C=CC=C2C(=O)C3=CNC4=CC=CC=C43
InChI
InChI=1S/C19H13NO/c21-19(17-12-20-18-11-4-3-9-15(17)18)16-10-5-7-13-6-1-2-8-14(13)16/h1-12,20H
InChIKey
QIXQGVQLBPQVOR-UHFFFAOYSA-N
Compound name
1H-indol-3-yl(naphthalen-1-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

271.0997 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.10698 161.3
[M+Na]+ 294.08892 170.8
[M-H]- 270.09242 167.8
[M+NH4]+ 289.13352 179.1
[M+K]+ 310.06286 163.6
[M+H-H2O]+ 254.09696 153.3
[M+HCOO]- 316.09790 182.3
[M+CH3COO]- 330.11355 173.5
[M+Na-2H]- 292.07437 167.7
[M]+ 271.09915 161.3
[M]- 271.10025 161.3
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