CID 44466638

Jwh-122

Structural Information

Molecular Formula
C25H25NO
SMILES
CCCCCN1C=C(C2=CC=CC=C21)C(=O)C3=CC=C(C4=CC=CC=C43)C
InChI
InChI=1S/C25H25NO/c1-3-4-9-16-26-17-23(21-12-7-8-13-24(21)26)25(27)22-15-14-18(2)19-10-5-6-11-20(19)22/h5-8,10-15,17H,3-4,9,16H2,1-2H3
InChIKey
HUKJQMKQFWYIHS-UHFFFAOYSA-N
Compound name
(4-methylnaphthalen-1-yl)-(1-pentylindol-3-yl)methanone
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

25
References

68
Patents

355.1936 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.20088 188.9
[M+Na]+ 378.18282 206.0
[M+NH4]+ 373.22742 198.3
[M+K]+ 394.15676 196.8
[M-H]- 354.18632 194.9
[M+Na-2H]- 376.16827 197.2
[M]+ 355.19305 193.4
[M]- 355.19415 193.4
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

patents stripe