CID 824845

N-methyl-n-ethyltryptamine

Structural Information

Molecular Formula
C13H18N2
SMILES
CCN(C)CCC1=CNC2=CC=CC=C21
InChI
InChI=1S/C13H18N2/c1-3-15(2)9-8-11-10-14-13-7-5-4-6-12(11)13/h4-7,10,14H,3,8-9H2,1-2H3
InChIKey
MYEGVMLMDWYPOA-UHFFFAOYSA-N
Compound name
N-ethyl-2-(1H-indol-3-yl)-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

100
Patents

202.147 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.15428 146.1
[M+Na]+ 225.13622 154.0
[M-H]- 201.13972 149.5
[M+NH4]+ 220.18082 166.8
[M+K]+ 241.11016 150.6
[M+H-H2O]+ 185.14426 139.1
[M+HCOO]- 247.14520 170.3
[M+CH3COO]- 261.16085 189.9
[M+Na-2H]- 223.12167 152.3
[M]+ 202.14645 148.0
[M]- 202.14755 148.0
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.