CID 23315

5-dimethylaminogramine bis methiodide

Structural Information

Molecular Formula
C15H25N3
SMILES
C[N+](C)(C)CC1=CNC2=C1C=C(C=C2)[N+](C)(C)C
InChI
InChI=1S/C15H25N3/c1-17(2,3)11-12-10-16-15-8-7-13(9-14(12)15)18(4,5)6/h7-10,16H,11H2,1-6H3/q+2
InChIKey
WBAGTVRVWVWQKX-UHFFFAOYSA-N
Compound name
trimethyl-[[5-(trimethylazaniumyl)-1H-indol-3-yl]methyl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

247.20485 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.212126 154.0
[M+Na]+ 270.194068 162.0
[M-H]- 246.197574 159.6
[M+NH4]+ 265.238673 173.4
[M+K]+ 286.168008 148.3
[M+H-H2O]+ 230.202110 153.3
[M+HCOO]- 292.203051 176.4
[M+CH3COO]- 306.218701 192.0
[M+Na-2H]- 268.179516 167.6
[M]+ 247.20430142 154.3
[M]- 247.20539858 154.3
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.