CID 11073952

N-[2-(hydroxymethyl)phenyl]prop-2-enamide

Structural Information

Molecular Formula
C10H11NO2
SMILES
C=CC(=O)NC1=CC=CC=C1CO
InChI
InChI=1S/C10H11NO2/c1-2-10(13)11-9-6-4-3-5-8(9)7-12/h2-6,12H,1,7H2,(H,11,13)
InChIKey
DRSBJVXETKOWBV-UHFFFAOYSA-N
Compound name
N-[2-(hydroxymethyl)phenyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

177.07898 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.08626 137.2
[M+Na]+ 200.06820 144.2
[M-H]- 176.07170 139.6
[M+NH4]+ 195.11280 156.4
[M+K]+ 216.04214 141.4
[M+H-H2O]+ 160.07624 131.4
[M+HCOO]- 222.07718 160.8
[M+CH3COO]- 236.09283 180.2
[M+Na-2H]- 198.05365 142.7
[M]+ 177.07843 136.0
[M]- 177.07953 136.0
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

patents stripe