CID 9578479

Brn 1510829

Structural Information

Molecular Formula
C22H35N3O3
SMILES
CCN(CC)CCO/N=C/1\CC2C3=CC(=C(C=C3CCN2CC1C)OC)OC
InChI
InChI=1S/C22H35N3O3/c1-6-24(7-2)10-11-28-23-19-14-20-18-13-22(27-5)21(26-4)12-17(18)8-9-25(20)15-16(19)3/h12-13,16,20H,6-11,14-15H2,1-5H3/b23-19+
InChIKey
NONQVWSZBONEEG-FCDQGJHFSA-N
Compound name
2-[(E)-(9,10-dimethoxy-3-methyl-1,3,4,6,7,11b-hexahydrobenzo[a]quinolizin-2-ylidene)amino]oxy-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

389.26785 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 390.27513 197.0
[M+Na]+ 412.25707 206.8
[M+NH4]+ 407.30167 204.0
[M+K]+ 428.23101 199.1
[M-H]- 388.26057 200.4
[M+Na-2H]- 410.24252 198.9
[M]+ 389.26730 199.1
[M]- 389.26840 199.1
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.