CID 13556092

Schembl1429226

Structural Information

Molecular Formula
C12H16N2O
SMILES
CN(C)CC1=CC2=C(N1)C=CC(=C2)OC
InChI
InChI=1S/C12H16N2O/c1-14(2)8-10-6-9-7-11(15-3)4-5-12(9)13-10/h4-7,13H,8H2,1-3H3
InChIKey
YSKVDCRGHJSLGZ-UHFFFAOYSA-N
Compound name
1-(5-methoxy-1H-indol-2-yl)-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
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

No literature data available for this compound.

Patent stripe

patents stripe