CID 430880

(5-methoxy-2-methyl-1h-indol-4-yl)methanamine

Structural Information

Molecular Formula
C11H14N2O
SMILES
CC1=CC2=C(N1)C=CC(=C2CN)OC
InChI
InChI=1S/C11H14N2O/c1-7-5-8-9(6-12)11(14-2)4-3-10(8)13-7/h3-5,13H,6,12H2,1-2H3
InChIKey
AZPRLTOKDKTBOM-UHFFFAOYSA-N
Compound name
(5-methoxy-2-methyl-1H-indol-4-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.11061 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.11789 140.1
[M+Na]+ 213.09983 150.6
[M-H]- 189.10333 142.6
[M+NH4]+ 208.14443 161.0
[M+K]+ 229.07377 146.4
[M+H-H2O]+ 173.10787 134.2
[M+HCOO]- 235.10881 164.0
[M+CH3COO]- 249.12446 184.2
[M+Na-2H]- 211.08528 145.7
[M]+ 190.11006 141.3
[M]- 190.11116 141.3
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.