CID 3044846

1-(2-diethylaminoethyl)-1,9-dimethyl-1,3,4,9-tetrahydropyrano(3,4-b)indole hydrochloride

Structural Information

Molecular Formula
C19H28N2O
SMILES
CCN(CC)CCC1(C2=C(CCO1)C3=CC=CC=C3N2C)C
InChI
InChI=1S/C19H28N2O/c1-5-21(6-2)13-12-19(3)18-16(11-14-22-19)15-9-7-8-10-17(15)20(18)4/h7-10H,5-6,11-14H2,1-4H3
InChIKey
YDSWVHHBVOVRPO-UHFFFAOYSA-N
Compound name
2-(1,9-dimethyl-3,4-dihydropyrano[3,4-b]indol-1-yl)-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.22015 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.22743 173.5
[M+Na]+ 323.20937 186.4
[M+NH4]+ 318.25397 184.1
[M+K]+ 339.18331 178.1
[M-H]- 299.21287 178.5
[M+Na-2H]- 321.19482 179.1
[M]+ 300.21960 177.1
[M]- 300.22070 177.1
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.