CID 23446

Brn 0998085

Structural Information

Molecular Formula
C15H21N3O
SMILES
CN(C)C1=CC2=C(C=C1)NC=C2CN3CCOCC3
InChI
InChI=1S/C15H21N3O/c1-17(2)13-3-4-15-14(9-13)12(10-16-15)11-18-5-7-19-8-6-18/h3-4,9-10,16H,5-8,11H2,1-2H3
InChIKey
FIDGDYWQUOBLQH-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-(morpholin-4-ylmethyl)-1H-indol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.16846 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.17574 160.4
[M+Na]+ 282.15768 166.7
[M-H]- 258.16118 165.6
[M+NH4]+ 277.20228 175.6
[M+K]+ 298.13162 163.9
[M+H-H2O]+ 242.16572 151.5
[M+HCOO]- 304.16666 178.9
[M+CH3COO]- 318.18231 171.5
[M+Na-2H]- 280.14313 164.7
[M]+ 259.16791 159.1
[M]- 259.16901 159.1
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.