CID 6438354

Bw a4c

Structural Information

Molecular Formula
C17H17NO3
SMILES
CC(=O)N(C/C=C/C1=CC(=CC=C1)OC2=CC=CC=C2)O
InChI
InChI=1S/C17H17NO3/c1-14(19)18(20)12-6-8-15-7-5-11-17(13-15)21-16-9-3-2-4-10-16/h2-11,13,20H,12H2,1H3/b8-6+
InChIKey
CEUDWZXMLMKPNN-SOFGYWHQSA-N
Compound name
N-hydroxy-N-[(E)-3-(3-phenoxyphenyl)prop-2-enyl]acetamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

78
References

127
Patents

283.12085 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 284.12813 166.6
[M+Na]+ 306.11007 179.1
[M+NH4]+ 301.15467 173.8
[M+K]+ 322.08401 172.2
[M-H]- 282.11357 170.5
[M+Na-2H]- 304.09552 174.7
[M]+ 283.12030 169.4
[M]- 283.12140 169.4
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