CID 119058030

Mn-18

Structural Information

Molecular Formula
C23H23N3O
SMILES
CCCCCN1C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC4=CC=CC=C43
InChI
InChI=1S/C23H23N3O/c1-2-3-8-16-26-21-15-7-6-13-19(21)22(25-26)23(27)24-20-14-9-11-17-10-4-5-12-18(17)20/h4-7,9-15H,2-3,8,16H2,1H3,(H,24,27)
InChIKey
UJKHLVOEXULDRU-UHFFFAOYSA-N
Compound name
N-naphthalen-1-yl-1-pentylindazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

4
References

28
Patents

357.1841 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.191376 187.8
[M+Na]+ 380.173318 195.7
[M-H]- 356.176824 193.6
[M+NH4]+ 375.217923 201.2
[M+K]+ 396.147258 188.4
[M+H-H2O]+ 340.181360 177.4
[M+HCOO]- 402.182301 208.4
[M+CH3COO]- 416.197951 197.7
[M+Na-2H]- 378.158766 192.3
[M]+ 357.18355142 190.9
[M]- 357.18464858 190.9
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