CID 208998

Brn 3997744

Structural Information

Molecular Formula
C19H23NO4
SMILES
COC1=CC(=CC(=C1OC)OC)C=NC(CC2=CC=CC=C2)CO
InChI
InChI=1S/C19H23NO4/c1-22-17-10-15(11-18(23-2)19(17)24-3)12-20-16(13-21)9-14-7-5-4-6-8-14/h4-8,10-12,16,21H,9,13H2,1-3H3
InChIKey
OXTWXKCMFVMIKR-UHFFFAOYSA-N
Compound name
3-phenyl-2-[(3,4,5-trimethoxyphenyl)methylideneamino]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.16272 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.17000 178.4
[M+Na]+ 352.15194 184.3
[M-H]- 328.15544 184.9
[M+NH4]+ 347.19654 192.1
[M+K]+ 368.12588 181.7
[M+H-H2O]+ 312.15998 169.5
[M+HCOO]- 374.16092 202.1
[M+CH3COO]- 388.17657 213.0
[M+Na-2H]- 350.13739 180.8
[M]+ 329.16217 184.0
[M]- 329.16327 184.0
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.