CID 3044848

1,3,4,9-tetrahydro-1,9-dimethyl-1-(2-pyrrolidinoethyl)pyrano(3,4-b)indole hydrochloride

Structural Information

Molecular Formula
C19H26N2O
SMILES
CC1(C2=C(CCO1)C3=CC=CC=C3N2C)CCN4CCCC4
InChI
InChI=1S/C19H26N2O/c1-19(10-13-21-11-5-6-12-21)18-16(9-14-22-19)15-7-3-4-8-17(15)20(18)2/h3-4,7-8H,5-6,9-14H2,1-2H3
InChIKey
IGIHFDJJCWNQNL-UHFFFAOYSA-N
Compound name
1,9-dimethyl-1-(2-pyrrolidin-1-ylethyl)-3,4-dihydropyrano[3,4-b]indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

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References

0
Patents

298.2045 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.21178 172.1
[M+Na]+ 321.19372 185.0
[M+NH4]+ 316.23832 182.9
[M+K]+ 337.16766 178.6
[M-H]- 297.19722 177.3
[M+Na-2H]- 319.17917 177.7
[M]+ 298.20395 175.7
[M]- 298.20505 175.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.