CID 129455

Fce 24220

Structural Information

Molecular Formula
C19H22N4O3
SMILES
C[N+]1(C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CN5CC(=O)NC5=O)[O-]
InChI
InChI=1S/C19H22N4O3/c1-23(26)10-11(8-22-9-17(24)21-19(22)25)5-14-13-3-2-4-15-18(13)12(7-20-15)6-16(14)23/h2-4,7,11,14,16,20H,5-6,8-10H2,1H3,(H,21,24,25)/t11-,14?,16+,23?/m0/s1
InChIKey
HTEWFCFFJOHVFC-PWOKGJIMSA-N
Compound name
1-[[(6aR,9S)-7-methyl-7-oxido-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinolin-7-ium-9-yl]methyl]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

354.1692 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.17648 183.7
[M+Na]+ 377.15842 196.1
[M+NH4]+ 372.20302 192.1
[M+K]+ 393.13236 193.3
[M-H]- 353.16192 185.1
[M+Na-2H]- 375.14387 184.7
[M]+ 354.16865 185.6
[M]- 354.16975 185.6
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

No patent data available for this compound.