CID 130451

98966-14-4

Structural Information

Molecular Formula
C16H16N2O4
SMILES
CC(=O)NC1=CC(=C(C=C1)O)C2=C(C=CC(=C2)NC(=O)C)O
InChI
InChI=1S/C16H16N2O4/c1-9(19)17-11-3-5-15(21)13(7-11)14-8-12(18-10(2)20)4-6-16(14)22/h3-8,21-22H,1-2H3,(H,17,19)(H,18,20)
InChIKey
PHJCCQZHFLRCAA-UHFFFAOYSA-N
Compound name
N-[3-(5-acetamido-2-hydroxyphenyl)-4-hydroxyphenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

3
Patents

300.111 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.118276 168.3
[M+Na]+ 323.100218 174.8
[M-H]- 299.103724 173.1
[M+NH4]+ 318.144823 181.6
[M+K]+ 339.074158 171.4
[M+H-H2O]+ 283.108260 160.6
[M+HCOO]- 345.109201 190.2
[M+CH3COO]- 359.124851 205.7
[M+Na-2H]- 321.085666 169.9
[M]+ 300.11045142 167.4
[M]- 300.11154858 167.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe