CID 51905

73623-17-3

Structural Information

Molecular Formula

C₁₀H₁₁NO₃

SMILES

C=CCOC(=O)NC1=CC(=CC=C1)O

InChI

InChI=1S/C10H11NO3/c1-2-6-14-10(13)11-8-4-3-5-9(12)7-8/h2-5,7,12H,1,6H2,(H,11,13)

InChIKey

ICDBJWGDHSNFJD-UHFFFAOYSA-N

Compound name

prop-2-enyl N-(3-hydroxyphenyl)carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 193.0739 Da
Monoisotopic Mass: 1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	194.081176	140.4
[M+Na]+	216.063118	147.3
[M-H]-	192.066624	142.8
[M+NH4]+	211.107723	158.9
[M+K]+	232.037058	145.1
[M+H-H2O]+	176.071160	134.3
[M+HCOO]-	238.072101	164.2
[M+CH3COO]-	252.087751	181.6
[M+Na-2H]-	214.048566	145.9
[M]+	193.07335142	140.5
[M]-	193.07444858	140.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe