CID 9569435

75393-01-0

Structural Information

Molecular Formula
C23H30N2O4
SMILES
CCN(CC)CCO/N=C/1\CC(OC2=CC=CC=C12)C3=CC(=C(C=C3)OC)OC
InChI
InChI=1S/C23H30N2O4/c1-5-25(6-2)13-14-28-24-19-16-22(29-20-10-8-7-9-18(19)20)17-11-12-21(26-3)23(15-17)27-4/h7-12,15,22H,5-6,13-14,16H2,1-4H3/b24-19+
InChIKey
OZKALSSMVORYTB-LYBHJNIJSA-N
Compound name
2-[(E)-[2-(3,4-dimethoxyphenyl)-2,3-dihydrochromen-4-ylidene]amino]oxy-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

398.22055 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.22783 198.6
[M+Na]+ 421.20977 211.0
[M+NH4]+ 416.25437 205.7
[M+K]+ 437.18371 203.0
[M-H]- 397.21327 205.8
[M+Na-2H]- 419.19522 204.5
[M]+ 398.22000 202.4
[M]- 398.22110 202.4
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.