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METHYL-2-(4-ACETYL-7-BROMO-5-HYDROXY-6-METHOXY-2,3-DIHYDRONAPHTHO-[1,2-B]-FURAN-2-YL)-ACETATE
SpectraBase Compound ID 1blquoQAP7l
InChI InChI=1S/C18H17BrO6/c1-8(20)14-11-6-9(7-13(21)23-2)25-17(11)10-4-5-12(19)18(24-3)15(10)16(14)22/h4-5,9,22H,6-7H2,1-3H3/t9-/m0/s1
InChIKey KTXIKURMJBBXSG-VIFPVBQESA-N
Mol Weight 409.23 g/mol
Molecular Formula C18H17BrO6
Exact Mass 408.020851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H4JDrC8Qilm
Name (S)-Methyl 2-(4'-acetyl-7'-bromo-5'-hydroxy-6'-methoxy-2',3'-dihydronaphtho[1,2-b]furan-2'-yl)acetate
Alternate Name(s) Methyl 2-(4'-acetyl-7'-bromo-5'-hydroxy-6'-methoxy-2',3'-dihydronaphtho[1,2-b]furan-2'-yl)acetate methyl[(2S)-4-acetyl-7-bromo-5-hydroxy-6-methoxy-2,3-dihydronaphtho[1,2-b]furan-2-yl]acetate
Comments Less than 3 mono-isotopic peaks
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Formula C18H17BrO6
InChI InChI=1S/C18H17BrO6/c1-8(20)14-11-6-9(7-13(21)23-2)25-17(11)10-4-5-12(19)18(24-3)15(10)16(14)22/h4-5,9,22H,6-7H2,1-3H3/t9-/m0/s1
InChIKey KTXIKURMJBBXSG-VIFPVBQESA-N
Molecular Weight 409.232 g/mol
SMILES Oc1c(c2C[C@](Oc2c2c1c(c(cc2)Br)OC)(CC(=O)OC)[H])C(=O)C
SPLASH splash10-00di-9000000000-5fb5c0a66d1db21a3eca
Source of Spectrum B-52-1027-17
Wiley ID 746895