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PANTOISOFURANOID-B
SpectraBase Compound ID H7jVs9f6P6n
InChI InChI=1S/C10H17BrO3/c1-9(2,13)8-6-7(12)10(3,14-8)4-5-11/h4-5,7-8,12-13H,6H2,1-3H3/b5-4+/t7-,8+,10-/m1/s1
InChIKey OPSVNFHESYGGIF-WFWWRNNBSA-N
Mol Weight 265.15 g/mol
Molecular Formula C10H17BrO3
Exact Mass 264.036107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G4RhHQFtZlU
Name (2R,3R,5S)-2-[(E)-2-bromanylethenyl]-2-methyl-5-(2-oxidanylpropan-2-yl)oxolan-3-ol
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Formula C10H17BrO3
InChI InChI=1S/C10H17BrO3/c1-9(2,13)8-6-7(12)10(3,14-8)4-5-11/h4-5,7-8,12-13H,6H2,1-3H3/b5-4+/t7-,8+,10-/m1/s1
InChIKey OPSVNFHESYGGIF-WFWWRNNBSA-N
Molecular Weight 265.147 g/mol
SMILES O[C@]1([C@](O[C@](C(O)(C)C)(C1)[H])(\C=C\Br)C)[H]
SPLASH splash10-0a4i-4900000000-948d056a3adddb040d5b
Source of Spectrum G4-61-20-5
Synonyms (2R,3R,5S)-2-[(E)-2-bromoethenyl]-5-(2-hydroxypropan-2-yl)-2-methyl-3-oxolanol (2R,3R,5S)-2-[(E)-2-bromoethenyl]-5-(2-hydroxypropan-2-yl)-2-methyloxolan-3-ol (2R,3R,5S)-2-[(E)-2-bromovinyl]-5-(1-hydroxy-1-methyl-ethyl)-2-methyl-tetrahydrofuran-3-ol
Wiley ID 1607059