CID 13398781

Pyrazino(1,2-a)indole, 1,2,3,4-tetrahydro-1,8-dimethyl-10-ethyl-, hydrochloride

Structural Information

Molecular Formula
C15H20N2
SMILES
CCC1=C2C(NCCN2C3=C1C=C(C=C3)C)C
InChI
InChI=1S/C15H20N2/c1-4-12-13-9-10(2)5-6-14(13)17-8-7-16-11(3)15(12)17/h5-6,9,11,16H,4,7-8H2,1-3H3
InChIKey
NBEWIUGRGMDDCU-UHFFFAOYSA-N
Compound name
10-ethyl-1,8-dimethyl-1,2,3,4-tetrahydropyrazino[1,2-a]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.16264 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.169916 154.5
[M+Na]+ 251.151858 164.5
[M-H]- 227.155364 156.3
[M+NH4]+ 246.196463 174.1
[M+K]+ 267.125798 158.5
[M+H-H2O]+ 211.159900 147.4
[M+HCOO]- 273.160841 171.9
[M+CH3COO]- 287.176491 166.5
[M+Na-2H]- 249.137306 158.3
[M]+ 228.16209142 154.1
[M]- 228.16318858 154.1
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.