CID 205487

1h-pyrido(3,4-b)indole, 2,3,4,9-tetrahydro-1-methyl-2-propyl-, hydrochloride

Structural Information

Molecular Formula
C15H20N2
SMILES
CCCN1CCC2=C(C1C)NC3=CC=CC=C23
InChI
InChI=1S/C15H20N2/c1-3-9-17-10-8-13-12-6-4-5-7-14(12)16-15(13)11(17)2/h4-7,11,16H,3,8-10H2,1-2H3
InChIKey
ZWANGODHJGISHB-UHFFFAOYSA-N
Compound name
1-methyl-2-propyl-1,3,4,9-tetrahydropyrido[3,4-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.16264 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.169916 154.2
[M+Na]+ 251.151858 163.2
[M-H]- 227.155364 155.5
[M+NH4]+ 246.196463 173.4
[M+K]+ 267.125798 157.3
[M+H-H2O]+ 211.159900 146.7
[M+HCOO]- 273.160841 171.6
[M+CH3COO]- 287.176491 165.8
[M+Na-2H]- 249.137306 158.8
[M]+ 228.16209142 153.4
[M]- 228.16318858 153.4
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.