CID 36830

N-(4-hydroxyphenyl)acrylamide

Structural Information

Molecular Formula
C9H9NO2
SMILES
C=CC(=O)NC1=CC=C(C=C1)O
InChI
InChI=1S/C9H9NO2/c1-2-9(12)10-7-3-5-8(11)6-4-7/h2-6,11H,1H2,(H,10,12)
InChIKey
POVITWJTUUJBNK-UHFFFAOYSA-N
Compound name
N-(4-hydroxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

2875
Patents

163.06332 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.07060 132.6
[M+Na]+ 186.05254 140.0
[M-H]- 162.05604 135.2
[M+NH4]+ 181.09714 152.3
[M+K]+ 202.02648 137.4
[M+H-H2O]+ 146.06058 127.0
[M+HCOO]- 208.06152 156.5
[M+CH3COO]- 222.07717 177.1
[M+Na-2H]- 184.03799 138.6
[M]+ 163.06277 131.0
[M]- 163.06387 131.0
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