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

*Links on SpectraBase are not permalinks.
1(3H)-Isobenzofuranone, 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-
SpectraBase Compound ID 7UBwu9uC0vo
InChI InChI=1S/C17H12O5/c18-13(10-5-6-14-16(7-10)21-9-20-14)8-15-11-3-1-2-4-12(11)17(19)22-15/h1-7,15H,8-9H2
InChIKey NHULEJBQQJQFCS-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C17H12O5
Exact Mass 296.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID IJyChmsPBxP
Name 1(3H)-Isobenzofuranone, 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12O5
InChI InChI=1S/C17H12O5/c18-13(10-5-6-14-16(7-10)21-9-20-14)8-15-11-3-1-2-4-12(11)17(19)22-15/h1-7,15H,8-9H2
InChIKey NHULEJBQQJQFCS-UHFFFAOYSA-N
Molecular Weight 296.278 g/mol
SMILES C(C1OC(c2c1cccc2)=O)C(c1cc2c(cc1)OCO2)=O
SPLASH splash10-0002-3910000000-f904345b0b9eecb5f294
Source of Spectrum IY-1-4379-0
Synonyms 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-3H-isobenzofuran-1-one 3-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-3H-2-benzofuran-1-one 3-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]-3H-isobenzofuran-1-one 3-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one
Wiley ID 1651773