CID 5745227

5,6-dimethoxy-1-methyl-1,2,3,8,9,9a-hexahydro-7h-benzo(de)quinolin-7-one oxime hydrochloride

Structural Information

Molecular Formula
C15H20N2O3
SMILES
CN1CCC2=CC(=C(C\3=C2C1CC/C3=N\O)OC)OC
InChI
InChI=1S/C15H20N2O3/c1-17-7-6-9-8-12(19-2)15(20-3)14-10(16-18)4-5-11(17)13(9)14/h8,11,18H,4-7H2,1-3H3/b16-10+
InChIKey
AZFVBWQNFMUIIX-MHWRWJLKSA-N
Compound name
(NE)-N-(5,6-dimethoxy-1-methyl-3,8,9,9a-tetrahydro-2H-benzo[de]quinolin-7-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.1474 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.15468 162.6
[M+Na]+ 299.13662 174.6
[M+NH4]+ 294.18122 170.9
[M+K]+ 315.11056 167.8
[M-H]- 275.14012 164.9
[M+Na-2H]- 297.12207 165.3
[M]+ 276.14685 164.8
[M]- 276.14795 164.8
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.