CID 215225

2h,6h-pyrido(1'',2'':3',4')imidazo(1',5':1,2)pyrido(3,4-b)indole, 1,3,4,8,9,14,14b,14c-octahydro-6,14-dimethyl-

Structural Information

Molecular Formula
C19H25N3
SMILES
CC1N2CCCCC2C3N1CCC4=C3N(C5=CC=CC=C45)C
InChI
InChI=1S/C19H25N3/c1-13-21-11-6-5-9-17(21)19-18-15(10-12-22(13)19)14-7-3-4-8-16(14)20(18)2/h3-4,7-8,13,17,19H,5-6,9-12H2,1-2H3
InChIKey
KQQMNFGRTBNQHL-UHFFFAOYSA-N
Compound name
9,20-dimethyl-8,10,20-triazapentacyclo[11.7.0.02,10.03,8.014,19]icosa-1(13),14,16,18-tetraene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.20483 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.21211 173.8
[M+Na]+ 318.19405 182.3
[M-H]- 294.19755 176.6
[M+NH4]+ 313.23865 193.0
[M+K]+ 334.16799 175.4
[M+H-H2O]+ 278.20209 164.7
[M+HCOO]- 340.20303 185.6
[M+CH3COO]- 354.21868 183.6
[M+Na-2H]- 316.17950 173.4
[M]+ 295.20428 171.1
[M]- 295.20538 171.1
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.