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
2
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]+ 232.144436 150.4
[M+Na]+ 254.126378 156.5
[M-H]- 230.129884 153.7
[M+NH4]+ 249.170983 169.2
[M+K]+ 270.100318 153.2
[M+H-H2O]+ 214.134420 142.4
[M+HCOO]- 276.135361 169.5
[M+CH3COO]- 290.151011 161.7
[M+Na-2H]- 252.111826 157.5
[M]+ 231.13661142 147.1
[M]- 231.13770858 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.