CID 109374220

1639810-41-5

Structural Information

Molecular Formula
C17H17NO5
SMILES
CO/N=C(\C1=CC=CC=C1COC2=CC=CC=C2CO)/C(=O)O
InChI
InChI=1S/C17H17NO5/c1-22-18-16(17(20)21)14-8-4-2-7-13(14)11-23-15-9-5-3-6-12(15)10-19/h2-9,19H,10-11H2,1H3,(H,20,21)/b18-16+
InChIKey
VYCKDLWRTQBZRB-FBMGVBCBSA-N
Compound name
(2E)-2-[2-[[2-(hydroxymethyl)phenoxy]methyl]phenyl]-2-methoxyiminoacetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.1107 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.11798 172.5
[M+Na]+ 338.09992 183.7
[M+NH4]+ 333.14452 178.0
[M+K]+ 354.07386 178.5
[M-H]- 314.10342 174.9
[M+Na-2H]- 336.08537 178.8
[M]+ 315.11015 174.4
[M]- 315.11125 174.4
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.