CID 604246

Folicanthine

Structural Information

Molecular Formula
C24H30N4
SMILES
CN1CCC2(C1N(C3=CC=CC=C32)C)C45CCN(C4N(C6=CC=CC=C56)C)C
InChI
InChI=1S/C24H30N4/c1-25-15-13-23(17-9-5-7-11-19(17)27(3)21(23)25)24-14-16-26(2)22(24)28(4)20-12-8-6-10-18(20)24/h5-12,21-22H,13-16H2,1-4H3
InChIKey
UEOHDZULNTUKEK-UHFFFAOYSA-N
Compound name
8b-(3,4-dimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indol-8b-yl)-3,4-dimethyl-2,3a-dihydro-1H-pyrrolo[2,3-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

11
Patents

374.24704 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.25432 195.1
[M+Na]+ 397.23626 205.4
[M-H]- 373.23976 201.8
[M+NH4]+ 392.28086 217.0
[M+K]+ 413.21020 198.0
[M+H-H2O]+ 357.24430 185.9
[M+HCOO]- 419.24524 207.5
[M+CH3COO]- 433.26089 204.7
[M+Na-2H]- 395.22171 188.5
[M]+ 374.24649 195.4
[M]- 374.24759 195.4
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