CID 42919

10-ethyl-n,n,1-trimethyl-1,2,3,4,5,10-hexahydrocyclohept(b)indole-1-ethanamine hydrochloride

Structural Information

Molecular Formula
C20H30N2
SMILES
CCC1C=CC=CC2=C1C3=C(N2)CCCC3(C)CCN(C)C
InChI
InChI=1S/C20H30N2/c1-5-15-9-6-7-10-16-18(15)19-17(21-16)11-8-12-20(19,2)13-14-22(3)4/h6-7,9-10,15,21H,5,8,11-14H2,1-4H3
InChIKey
BRKVIAVSVZHLCY-UHFFFAOYSA-N
Compound name
2-(10-ethyl-1-methyl-3,4,5,10-tetrahydro-2H-cyclohepta[b]indol-1-yl)-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.2409 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.24818 171.2
[M+Na]+ 321.23012 180.2
[M+NH4]+ 316.27472 180.7
[M+K]+ 337.20406 173.8
[M-H]- 297.23362 174.0
[M+Na-2H]- 319.21557 175.9
[M]+ 298.24035 173.4
[M]- 298.24145 173.4
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.