CID 594939

[(4-methoxy-1h-indol-3-yl)methyl]dimethylamine

Structural Information

Molecular Formula
C12H16N2O
SMILES
CN(C)CC1=CNC2=C1C(=CC=C2)OC
InChI
InChI=1S/C12H16N2O/c1-14(2)8-9-7-13-10-5-4-6-11(15-3)12(9)10/h4-7,13H,8H2,1-3H3
InChIKey
UTDGDGFOENJMAA-UHFFFAOYSA-N
Compound name
1-(4-methoxy-1H-indol-3-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

204.12627 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.133546 144.6
[M+Na]+ 227.115488 153.8
[M-H]- 203.118994 148.5
[M+NH4]+ 222.160093 165.4
[M+K]+ 243.089428 151.1
[M+H-H2O]+ 187.123530 137.9
[M+HCOO]- 249.124471 169.2
[M+CH3COO]- 263.140121 190.1
[M+Na-2H]- 225.100936 150.6
[M]+ 204.12572142 147.9
[M]- 204.12681858 147.9
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

patents stripe