CID 289509

99812-94-9

Structural Information

Molecular Formula
C18H22N2O2
SMILES
CCC12CCC(=O)NC1CC3=C(C2)C4=C(N3)C(=CC=C4)OC
InChI
InChI=1S/C18H22N2O2/c1-3-18-8-7-16(21)20-15(18)9-13-12(10-18)11-5-4-6-14(22-2)17(11)19-13/h4-6,15,19H,3,7-10H2,1-2H3,(H,20,21)
InChIKey
ZYBCVMGAWAPRGV-UHFFFAOYSA-N
Compound name
4a-ethyl-9-methoxy-3,4,5,10,11,11a-hexahydro-1H-pyrido[2,3-b]carbazol-2-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

298.16812 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.17540 172.2
[M+Na]+ 321.15734 184.6
[M+NH4]+ 316.20194 182.1
[M+K]+ 337.13128 176.8
[M-H]- 297.16084 173.7
[M+Na-2H]- 319.14279 175.6
[M]+ 298.16757 174.4
[M]- 298.16867 174.4
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

No patent data available for this compound.