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]+ 229.16992 154.5
[M+Na]+ 251.15186 164.5
[M-H]- 227.15536 156.3
[M+NH4]+ 246.19646 174.1
[M+K]+ 267.12580 158.5
[M+H-H2O]+ 211.15990 147.4
[M+HCOO]- 273.16084 171.9
[M+CH3COO]- 287.17649 166.5
[M+Na-2H]- 249.13731 158.3
[M]+ 228.16209 154.1
[M]- 228.16319 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.