CID 202995

2-methoxy-5,6,6a,7,7a,8,9,10,11,12a-decahydrobenzo(g)pyrido(1,2-a)indole hydrochloride

Structural Information

Molecular Formula
C17H23NO
SMILES
COC1=CC2=C(CCC3C2N4CCCCC4C3)C=C1
InChI
InChI=1S/C17H23NO/c1-19-15-8-7-12-5-6-13-10-14-4-2-3-9-18(14)17(13)16(12)11-15/h7-8,11,13-14,17H,2-6,9-10H2,1H3
InChIKey
IMMKPTDCNDLBHD-UHFFFAOYSA-N
Compound name
2-methoxy-5,6,6a,7,7a,8,9,10,11,12a-decahydronaphtho[2,1-b]indolizine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.17798 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.18526 161.7
[M+Na]+ 280.16720 173.7
[M+NH4]+ 275.21180 172.6
[M+K]+ 296.14114 166.8
[M-H]- 256.17070 165.3
[M+Na-2H]- 278.15265 164.6
[M]+ 257.17743 164.4
[M]- 257.17853 164.4
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.