CID 53394445

1427325-32-3

Structural Information

Molecular Formula
C24H23NO2
SMILES
CCCCCN1C2=CC=CC=C2C(=C1O)C(=O)C3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C24H23NO2/c1-2-3-8-16-25-21-15-7-6-13-20(21)22(24(25)27)23(26)19-14-9-11-17-10-4-5-12-18(17)19/h4-7,9-15,27H,2-3,8,16H2,1H3
InChIKey
LSYJCVSGIQLLKF-UHFFFAOYSA-N
Compound name
(2-hydroxy-1-pentylindol-3-yl)-naphthalen-1-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

357.17288 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.18016 188.7
[M+Na]+ 380.16210 197.3
[M-H]- 356.16560 194.9
[M+NH4]+ 375.20670 203.3
[M+K]+ 396.13604 189.9
[M+H-H2O]+ 340.17014 179.7
[M+HCOO]- 402.17108 207.8
[M+CH3COO]- 416.18673 198.9
[M+Na-2H]- 378.14755 190.8
[M]+ 357.17233 192.3
[M]- 357.17343 192.3
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