John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=CnRhAQYu1gi SpectraBase Spectrum ID=4xyIWjUdJey

(accessed ).
4-Methyl-5'-(iodomethyl)-4',5'-dihydro-angelicin
SpectraBase Compound ID CnRhAQYu1gi
InChI InChI=1S/C13H11IO3/c1-7-4-12(15)17-13-9(7)2-3-11-10(13)5-8(6-14)16-11/h2-4,8H,5-6H2,1H3
InChIKey OOEHZIMKDMBYSC-UHFFFAOYSA-N
Mol Weight 342.13 g/mol
Molecular Formula C13H11IO3
Exact Mass 341.975296 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID 4xyIWjUdJey
Name 4-Methyl-5'-(iodomethyl)-4',5'-dihydro-angelicin
Alternate Name(s) 4-Methyl-2-(iodomethyl)-5H-furo[2,3-c]benzopyran-2-one 8-Iodomethyl-4-methyl-8,9-dihydro-furo[2,3-h]chromen-2-one
Classification Angular furanocoumarins
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Formula C13H11IO3
InChI InChI=1S/C13H11IO3/c1-7-4-12(15)17-13-9(7)2-3-11-10(13)5-8(6-14)16-11/h2-4,8H,5-6H2,1H3
InChIKey OOEHZIMKDMBYSC-UHFFFAOYSA-N
SPLASH splash10-0006-0019000000-daa63c6914ac75b1acf0
Source of Spectrum Y-38-915-18
SpectraBase Batch ID HtX4VDLwGct