CID 25927

Indole, 3-(2-(dimethylamino)ethyl)-1-methyl-

Structural Information

Molecular Formula
C13H18N2
SMILES
CN1C=C(C2=CC=CC=C21)CCN(C)C
InChI
InChI=1S/C13H18N2/c1-14(2)9-8-11-10-15(3)13-7-5-4-6-12(11)13/h4-7,10H,8-9H2,1-3H3
InChIKey
WYFWKMQPMCPKLZ-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(1-methylindol-3-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

27
Patents

202.147 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.154276 145.7
[M+Na]+ 225.136218 155.0
[M-H]- 201.139724 150.9
[M+NH4]+ 220.180823 167.5
[M+K]+ 241.110158 152.5
[M+H-H2O]+ 185.144260 138.7
[M+HCOO]- 247.145201 171.3
[M+CH3COO]- 261.160851 193.7
[M+Na-2H]- 223.121666 151.6
[M]+ 202.14645142 149.9
[M]- 202.14754858 149.9
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