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1(3H)-Isobenzofuranone, 3-methyl-3-(2,4,6-trimethoxyphenyl)-
SpectraBase Compound ID Hz62srVznAZ
InChI InChI=1S/C18H18O5/c1-18(13-8-6-5-7-12(13)17(19)23-18)16-14(21-3)9-11(20-2)10-15(16)22-4/h5-10H,1-4H3
InChIKey AOZLJXDHOISBON-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C18H18O5
Exact Mass 314.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7i23FKhoaD1
Name 1(3H)-Isobenzofuranone, 3-methyl-3-(2,4,6-trimethoxyphenyl)-
Alternate Name(s) 3-methyl-3-(2,4,6-trimethoxyphenyl)-2-benzofuran-1(3H)-one 3-Methyl-3-(2,4,6-trimethoxyphenyl)phthalide
CAS Registry Number 64042-53-1
Comments Less than 3 mono-isotopic peaks
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Formula C18H18O5
InChI InChI=1S/C18H18O5/c1-18(13-8-6-5-7-12(13)17(19)23-18)16-14(21-3)9-11(20-2)10-15(16)22-4/h5-10H,1-4H3
InChIKey AOZLJXDHOISBON-UHFFFAOYSA-N
Molecular Weight 314.337 g/mol
SMILES C1(c2c(cc(cc2OC)OC)OC)(OC(=O)c2c1cccc2)C
SPLASH splash10-03di-0009000000-9210013d3904c5c00779
Source of Spectrum K-110-2605-0
Wiley ID 1315083