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Pyranosylmagellanicus B [4-Acetoxy-2-hydroxy-3-chloro-6-popyl-2-(dibroomomethyl)tetrahydropyran]
SpectraBase Compound ID JLVmVk6XKYm
InChI InChI=1S/C11H17Br2ClO4/c1-3-4-7-5-8(17-6(2)15)9(14)11(16,18-7)10(12)13/h7-10,16H,3-5H2,1-2H3/t7-,8+,9+,11-/m1/s1
InChIKey MSHMBKPBCVOIHB-UYAYMFIHSA-N
Mol Weight 408.51 g/mol
Molecular Formula C11H17Br2ClO4
Exact Mass 405.918213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6IXldjgWh6P
Name Pyranosylmagellanicus B [4-Acetoxy-2-hydroxy-3-chloro-6-popyl-2-(dibroomomethyl)tetrahydropyran]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H17Br2ClO4
InChI InChI=1S/C11H17Br2ClO4/c1-3-4-7-5-8(17-6(2)15)9(14)11(16,18-7)10(12)13/h7-10,16H,3-5H2,1-2H3/t7-,8+,9+,11-/m1/s1
InChIKey MSHMBKPBCVOIHB-UYAYMFIHSA-N
Molecular Weight 408.514 g/mol
SMILES O[C@@]1([C@]([C@@](OC(=O)C)(C[C@](O1)(CCC)[H])[H])(Cl)[H])C(Br)Br
SPLASH splash10-001i-0900000000-81f27ded891e69bbc58b
Source of Spectrum KC-61-9553-2
Wiley ID 1630711