CID 4380399

N-(2-methoxyphenyl)prop-2-enamide

Structural Information

Molecular Formula
C10H11NO2
SMILES
COC1=CC=CC=C1NC(=O)C=C
InChI
InChI=1S/C10H11NO2/c1-3-10(12)11-8-6-4-5-7-9(8)13-2/h3-7H,1H2,2H3,(H,11,12)
InChIKey
UPONHMPNVZINND-UHFFFAOYSA-N
Compound name
N-(2-methoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

177.07898 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.08626 136.5
[M+Na]+ 200.06820 143.9
[M-H]- 176.07170 140.4
[M+NH4]+ 195.11280 156.5
[M+K]+ 216.04214 142.1
[M+H-H2O]+ 160.07624 130.5
[M+HCOO]- 222.07718 161.7
[M+CH3COO]- 236.09283 182.7
[M+Na-2H]- 198.05365 142.6
[M]+ 177.07843 137.2
[M]- 177.07953 137.2
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