CID 355889

118953-89-2

Structural Information

Molecular Formula
C18H24N2O
SMILES
COC1=CC2=C(C=C1)NC=C2C3CCCN4C3CCCC4
InChI
InChI=1S/C18H24N2O/c1-21-13-7-8-17-15(11-13)16(12-19-17)14-5-4-10-20-9-3-2-6-18(14)20/h7-8,11-12,14,18-19H,2-6,9-10H2,1H3
InChIKey
DCUPHCGTKTVPQM-UHFFFAOYSA-N
Compound name
1-(5-methoxy-1H-indol-3-yl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.18887 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.19615 168.0
[M+Na]+ 307.17809 173.6
[M-H]- 283.18159 171.3
[M+NH4]+ 302.22269 183.9
[M+K]+ 323.15203 167.4
[M+H-H2O]+ 267.18613 158.7
[M+HCOO]- 329.18707 181.5
[M+CH3COO]- 343.20272 177.3
[M+Na-2H]- 305.16354 170.0
[M]+ 284.18832 162.6
[M]- 284.18942 162.6
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.