For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-Hydroxy-1-[3,4-(methylenedioxy)phenyl]-2-butanone

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

1-Hydroxy-1-[3,4-(methylenedioxy)phenyl]-2-butanone
SpectraBase Compound ID CXf1FBdA2TI
InChI InChI=1S/C11H12O4/c1-2-8(12)11(13)7-3-4-9-10(5-7)15-6-14-9/h3-5,11,13H,2,6H2,1H3
InChIKey NPVCMHYBDJPVRB-UHFFFAOYSA-N
Mol Weight 208.21 g/mol
Molecular Formula C11H12O4
Exact Mass 208.073559 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FffXft00U1l
Name 1-Hydroxy-1-[3,4-(methylenedioxy)phenyl]-2-butanone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 208.073558862 u
Formula C11H12O4
InChI InChI=1S/C11H12O4/c1-2-8(12)11(13)7-3-4-9-10(5-7)15-6-14-9/h3-5,11,13H,2,6H2,1H3
InChIKey NPVCMHYBDJPVRB-UHFFFAOYSA-N
Molecular Weight 208.213 g/mol
SMILES C=1(C=C2OCOC2=CC1)C(C(=O)CC)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.953403