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3-Ethyl-4-(2'-iodo-3'-methyl-3'-hydroxyl-1'(Z)-butenyl)-5-phenyl-2(5H)-furanone
SpectraBase Compound ID 9OcYJ4zSFix
InChI InChI=1S/C17H19IO3/c1-4-12-13(10-14(18)17(2,3)20)15(21-16(12)19)11-8-6-5-7-9-11/h5-10,15,20H,4H2,1-3H3/b14-10-
InChIKey FBJRGBPXEPPAPB-UVTDQMKNSA-N
Mol Weight 398.24 g/mol
Molecular Formula C17H19IO3
Exact Mass 398.037889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NT5TJxAaUk
Name 3-Ethyl-4-(2'-iodo-3'-methyl-3'-hydroxyl-1'(Z)-butenyl)-5-phenyl-2(5H)-furanone
Alternate Name(s) (Z)-3-ethyl-4-(3-hydroxy-2-iodo-3-methylbut-1-en-1-yl)-5-phenylfuran-2(5H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19IO3
InChI InChI=1S/C17H19IO3/c1-4-12-13(10-14(18)17(2,3)20)15(21-16(12)19)11-8-6-5-7-9-11/h5-10,15,20H,4H2,1-3H3/b14-10-
InChIKey FBJRGBPXEPPAPB-UVTDQMKNSA-N
Literature Reference DOI 10.1002/adsc.200700181
Molecular Weight 398.240 g/mol
SMILES OC(\C(=C\C1=C(CC)C(=O)OC1c1ccccc1)I)(C)C
SPLASH splash10-0f6x-9080000000-9a5a134ccfea6c2b0f89
Source of Spectrum ASC-349-1653/SM4-Z_2c
Wiley ID 1765353