CID 5383247

1h,5h-benzo(ij)quinolizin-1-one, 2,3,6,7-tetrahydro-9-methoxy-, hydrazone

Structural Information

Molecular Formula
C13H17N3O
SMILES
COC1=CC2=C3C(=C1)/C(=N/N)/CCN3CCC2
InChI
InChI=1S/C13H17N3O/c1-17-10-7-9-3-2-5-16-6-4-12(15-14)11(8-10)13(9)16/h7-8H,2-6,14H2,1H3/b15-12+
InChIKey
CJVBLSITOSCWPE-NTCAYCPXSA-N
Compound name
(E)-(7-methoxy-1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-trien-4-ylidene)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.13716 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.14444 150.4
[M+Na]+ 254.12638 156.5
[M-H]- 230.12988 153.7
[M+NH4]+ 249.17098 169.2
[M+K]+ 270.10032 153.2
[M+H-H2O]+ 214.13442 142.4
[M+HCOO]- 276.13536 169.5
[M+CH3COO]- 290.15101 161.7
[M+Na-2H]- 252.11183 157.5
[M]+ 231.13661 147.1
[M]- 231.13771 147.1
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.