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

*Links on SpectraBase are not permalinks.
1,3-Isobenzofurandione, 6-(4-methoxyphenyl)-4-(methylthio)-
SpectraBase Compound ID 3lgmy4KzRpm
InChI InChI=1S/C16H12O4S/c1-19-11-5-3-9(4-6-11)10-7-12-14(13(8-10)21-2)16(18)20-15(12)17/h3-8H,1-2H3
InChIKey GRHCMQIZVIJEJD-UHFFFAOYSA-N
Mol Weight 300.33 g/mol
Molecular Formula C16H12O4S
Exact Mass 300.04563 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 2oKRgJW1YOM
Name 1,3-Isobenzofurandione, 6-(4-methoxyphenyl)-4-(methylthio)-
CAS Registry Number 123559-22-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O4S
InChI InChI=1S/C16H12O4S/c1-19-11-5-3-9(4-6-11)10-7-12-14(13(8-10)21-2)16(18)20-15(12)17/h3-8H,1-2H3
InChIKey GRHCMQIZVIJEJD-UHFFFAOYSA-N
Molecular Weight 300.328 g/mol
SMILES c12C(OC(c2cc(cc1SC)-c1ccc(cc1)OC)=O)=O
SPLASH splash10-0udi-0059000000-8456e28b5b516966623a
Source of Spectrum F-45-1515-9
Synonyms 5-(4-Methoxyphenyl)-3-methylthiophthalic anhydride 6-(4-Methoxyphenyl)-4-(methylsulfanyl)-2-benzofuran-1,3-dione
Wiley ID 1302681