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4-(trans-2-Iodocyclopentyl)-8-methoxy-[1]benzopyran-2-one
SpectraBase Compound ID 4GINLte2hZk
InChI InChI=1S/C15H15IO4/c1-19-11-7-3-5-9-12(8-4-2-6-10(8)16)13(17)15(18)20-14(9)11/h3,5,7-8,10,17H,2,4,6H2,1H3/t8-,10-/m1/s1
InChIKey RZJWEYSEFTVDDQ-PSASIEDQSA-N
Mol Weight 386.19 g/mol
Molecular Formula C15H15IO4
Exact Mass 386.001504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID rcH9gkiN3o
Name 4-(trans-2-Iodocyclopentyl)-8-methoxy-[1]benzopyran-2-one
Alternate Name(s) 3-Hydroxy-4-(trans-2-Iodocyclopentyl)-8-methoxy-[1]benzopyran-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C15H15IO4
InChI InChI=1S/C15H15IO4/c1-19-11-7-3-5-9-12(8-4-2-6-10(8)16)13(17)15(18)20-14(9)11/h3,5,7-8,10,17H,2,4,6H2,1H3/t8-,10-/m1/s1
InChIKey RZJWEYSEFTVDDQ-PSASIEDQSA-N
Molecular Weight 386.185 g/mol
SMILES OC=1C(Oc2c(C1[C@]1([C@](I)(CCC1)[H])[H])cccc2OC)=O
SPLASH splash10-0a4i-0092000000-5fc84eeb11a7693fe904
Source of Spectrum KC-0-2841-33
Wiley ID 780270