CID 384627

Nsc674641

Structural Information

Molecular Formula
C22H24N2O
SMILES
CN1C2=CC=CC=C2C(=C1C3=CC=CC=C3)CCNC(=O)C4CCC4
InChI
InChI=1S/C22H24N2O/c1-24-20-13-6-5-12-18(20)19(21(24)16-8-3-2-4-9-16)14-15-23-22(25)17-10-7-11-17/h2-6,8-9,12-13,17H,7,10-11,14-15H2,1H3,(H,23,25)
InChIKey
UFWPPEAPUSUWND-UHFFFAOYSA-N
Compound name
N-[2-(1-methyl-2-phenylindol-3-yl)ethyl]cyclobutanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

332.18887 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.19615 179.3
[M+Na]+ 355.17809 184.7
[M-H]- 331.18159 188.1
[M+NH4]+ 350.22269 187.7
[M+K]+ 371.15203 181.9
[M+H-H2O]+ 315.18613 164.6
[M+HCOO]- 377.18707 200.0
[M+CH3COO]- 391.20272 189.3
[M+Na-2H]- 353.16354 180.8
[M]+ 332.18832 188.6
[M]- 332.18942 188.6
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

No patent data available for this compound.