CID 2763156

96096-55-8

Structural Information

Molecular Formula
C15H22N2O
SMILES
CC(C)N(C)CCC1=CNC2=C1C=C(C=C2)OC
InChI
InChI=1S/C15H22N2O/c1-11(2)17(3)8-7-12-10-16-15-6-5-13(18-4)9-14(12)15/h5-6,9-11,16H,7-8H2,1-4H3
InChIKey
HEDOODBJFVUQMS-UHFFFAOYSA-N
Compound name
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]-N-methylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

593
Patents

246.17322 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.18050 159.3
[M+Na]+ 269.16244 166.8
[M-H]- 245.16594 162.8
[M+NH4]+ 264.20704 178.4
[M+K]+ 285.13638 164.0
[M+H-H2O]+ 229.17048 152.1
[M+HCOO]- 291.17142 181.9
[M+CH3COO]- 305.18707 200.0
[M+Na-2H]- 267.14789 162.5
[M]+ 246.17267 163.1
[M]- 246.17377 163.1
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