CID 91734859

1-naphthalenyl(1-pentyl-1h-indol-3-yl)methanone

Structural Information

Molecular Formula
C24H23NO
SMILES
CCCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC4=CC=CC=C4C=C3
InChI
InChI=1S/C24H23NO/c1-2-3-8-15-25-17-22(21-11-6-7-12-23(21)25)24(26)20-14-13-18-9-4-5-10-19(18)16-20/h4-7,9-14,16-17H,2-3,8,15H2,1H3
InChIKey
ZAOKDVBETBFRSN-UHFFFAOYSA-N
Compound name
naphthalen-2-yl-(1-pentylindol-3-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

341.17798 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.185256 185.5
[M+Na]+ 364.167198 193.9
[M-H]- 340.170704 192.6
[M+NH4]+ 359.211803 201.2
[M+K]+ 380.141138 186.5
[M+H-H2O]+ 324.175240 176.1
[M+HCOO]- 386.176181 206.0
[M+CH3COO]- 400.191831 196.2
[M+Na-2H]- 362.152646 188.5
[M]+ 341.17743142 189.1
[M]- 341.17852858 189.1
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