CID 3049876

6-methyl-3-propyl-2,3,3a,4,5,6-hexahydro-1h-indolo(3,2,1-de)(1,5)naphthyridin-6-ol

Structural Information

Molecular Formula
C18H24N2O
SMILES
CCCN1CCC2=C3C1CCC(N3C4=CC=CC=C24)(C)O
InChI
InChI=1S/C18H24N2O/c1-3-11-19-12-9-14-13-6-4-5-7-15(13)20-17(14)16(19)8-10-18(20,2)21/h4-7,16,21H,3,8-12H2,1-2H3
InChIKey
ZHFSWFVBQUOWTF-UHFFFAOYSA-N
Compound name
2-methyl-6-propyl-1,6-diazatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.18887 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.19615 169.1
[M+Na]+ 307.17809 182.5
[M+NH4]+ 302.22269 180.2
[M+K]+ 323.15203 173.8
[M-H]- 283.18159 171.3
[M+Na-2H]- 305.16354 173.1
[M]+ 284.18832 171.9
[M]- 284.18942 171.9
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.