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]+ 296.212106 173.8
[M+Na]+ 318.194048 182.3
[M-H]- 294.197554 176.6
[M+NH4]+ 313.238653 193.0
[M+K]+ 334.167988 175.4
[M+H-H2O]+ 278.202090 164.7
[M+HCOO]- 340.203031 185.6
[M+CH3COO]- 354.218681 183.6
[M+Na-2H]- 316.179496 173.4
[M]+ 295.20428142 171.1
[M]- 295.20537858 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.