CID 5745227

41829-09-8

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]+ 277.154676 163.1
[M+Na]+ 299.136618 170.3
[M-H]- 275.140124 166.0
[M+NH4]+ 294.181223 180.5
[M+K]+ 315.110558 167.4
[M+H-H2O]+ 259.144660 155.4
[M+HCOO]- 321.145601 179.9
[M+CH3COO]- 335.161251 205.5
[M+Na-2H]- 297.122066 167.9
[M]+ 276.14685142 164.0
[M]- 276.14794858 164.0
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.