CID 23059

Ammonium, (2-(5-methoxyindol-3-yl)ethyl)trimethyl-, iodide

Structural Information

Molecular Formula
C14H21N2O
SMILES
C[N+](C)(C)CCC1=C(NC2=CC=CC=C21)OC
InChI
InChI=1S/C14H21N2O/c1-16(2,3)10-9-12-11-7-5-6-8-13(11)15-14(12)17-4/h5-8,15H,9-10H2,1-4H3/q+1
InChIKey
KHPJBAGZFOVJKB-UHFFFAOYSA-N
Compound name
2-(2-methoxy-1H-indol-3-yl)ethyl-trimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.16539 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.17267 153.1
[M+Na]+ 256.15461 161.8
[M-H]- 232.15811 157.1
[M+NH4]+ 251.19921 172.9
[M+K]+ 272.12855 153.0
[M+H-H2O]+ 216.16265 149.5
[M+HCOO]- 278.16359 175.9
[M+CH3COO]- 292.17924 188.9
[M+Na-2H]- 254.14006 162.6
[M]+ 233.16484 155.5
[M]- 233.16594 155.5
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.