CID 23273

Brn 0477609

Structural Information

Molecular Formula
C14H21N3
SMILES
CN(C)CCC1=CNC2=C1C=C(C=C2)N(C)C
InChI
InChI=1S/C14H21N3/c1-16(2)8-7-11-10-15-14-6-5-12(17(3)4)9-13(11)14/h5-6,9-10,15H,7-8H2,1-4H3
InChIKey
KCUZCIHDOGQSBO-UHFFFAOYSA-N
Compound name
3-[2-(dimethylamino)ethyl]-N,N-dimethyl-1H-indol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.17355 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.180826 154.9
[M+Na]+ 254.162768 162.5
[M-H]- 230.166274 159.9
[M+NH4]+ 249.207373 174.9
[M+K]+ 270.136708 160.2
[M+H-H2O]+ 214.170810 147.3
[M+HCOO]- 276.171751 180.1
[M+CH3COO]- 290.187401 202.5
[M+Na-2H]- 252.148216 159.5
[M]+ 231.17300142 158.0
[M]- 231.17409858 158.0
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.