CID 217863

9-(beta-dimethylaminoethyl)-5,6,7,8-tetrahydro-gamma-carboline dihydrochloride

Structural Information

Molecular Formula
C15H21N3
SMILES
CN(C)CCN1C2=C(CCCC2)C3=C1C=CN=C3
InChI
InChI=1S/C15H21N3/c1-17(2)9-10-18-14-6-4-3-5-12(14)13-11-16-8-7-15(13)18/h7-8,11H,3-6,9-10H2,1-2H3
InChIKey
NLNQZYVTFDZQTR-UHFFFAOYSA-N
Compound name
N,N-dimethyl-2-(6,7,8,9-tetrahydropyrido[4,3-b]indol-5-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.17355 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.18083 156.9
[M+Na]+ 266.16277 164.5
[M-H]- 242.16627 160.6
[M+NH4]+ 261.20737 176.1
[M+K]+ 282.13671 160.8
[M+H-H2O]+ 226.17081 148.2
[M+HCOO]- 288.17175 177.3
[M+CH3COO]- 302.18740 168.8
[M+Na-2H]- 264.14822 162.5
[M]+ 243.17300 158.0
[M]- 243.17410 158.0
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.