CID 395810

66012-82-6

Structural Information

Molecular Formula
C14H18N2O2
SMILES
CCC(=O)NCCC1=CNC2=C1C=C(C=C2)OC
InChI
InChI=1S/C14H18N2O2/c1-3-14(17)15-7-6-10-9-16-13-5-4-11(18-2)8-12(10)13/h4-5,8-9,16H,3,6-7H2,1-2H3,(H,15,17)
InChIKey
VXGNHTKZJOTYNZ-UHFFFAOYSA-N
Compound name
N-[2-(5-methoxy-1H-indol-3-yl)ethyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

5
Patents

246.13683 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.14411 156.7
[M+Na]+ 269.12605 167.9
[M+NH4]+ 264.17065 163.9
[M+K]+ 285.09999 163.3
[M-H]- 245.12955 157.8
[M+Na-2H]- 267.11150 161.4
[M]+ 246.13628 158.4
[M]- 246.13738 158.4
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