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(2E,4E)-N-[(1R,5S,6S)-5-[(E)-2-bromanylethenyl]-5-oxidanyl-2-oxidanylidene-7-oxabicyclo[4.1.0]hept-3-en-3-yl]hexa-2,4-dienamide

View entire compound with spectra: 1 MS (GC)

(2E,4E)-N-[(1R,5S,6S)-5-[(E)-2-bromanylethenyl]-5-oxidanyl-2-oxidanylidene-7-oxabicyclo[4.1.0]hept-3-en-3-yl]hexa-2,4-dienamide
SpectraBase Compound ID 8DapcBz5QNq
InChI InChI=1S/C14H14BrNO4/c1-2-3-4-5-10(17)16-9-8-14(19,6-7-15)13-12(20-13)11(9)18/h2-8,12-13,19H,1H3,(H,16,17)/b3-2+,5-4+,7-6+/t12-,13-,14+/m0/s1
InChIKey PUAYXYQNCSZJMG-MEYHICJESA-N
Mol Weight 340.17 g/mol
Molecular Formula C14H14BrNO4
Exact Mass 339.010621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45mp41folXZ
Name (2E,4E)-N-[(1R,5S,6S)-5-[(E)-2-bromanylethenyl]-5-oxidanyl-2-oxidanylidene-7-oxabicyclo[4.1.0]hept-3-en-3-yl]hexa-2,4-dienamide
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Formula C14H14BrNO4
InChI InChI=1S/C14H14BrNO4/c1-2-3-4-5-10(17)16-9-8-14(19,6-7-15)13-12(20-13)11(9)18/h2-8,12-13,19H,1H3,(H,16,17)/b3-2+,5-4+,7-6+/t12-,13-,14+/m0/s1
InChIKey PUAYXYQNCSZJMG-MEYHICJESA-N
Molecular Weight 340.173 g/mol
SMILES O[C@]1([C@@]2([C@](C(C(=C1)NC(\C=C\C=C\C)=O)=O)(O2)[H])[H])\C=C\Br
SPLASH splash10-0002-9200000000-f6c2cfdf11d1f05ae4a0
Source of Spectrum J-64-5060-25
Synonyms (2E,4E)-N-[(1R,5S,6S)-5-[(E)-2-bromoethenyl]-5-hydroxy-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]hexa-2,4-dienamide (2E,4E)-N-[(1R,5S,6S)-5-[(E)-2-bromovinyl]-5-hydroxy-2-keto-7-oxabicyclo[4.1.0]hept-3-en-3-yl]hexa-2,4-dienamide (2E,4E)-N-[(1R,5S,6S)-5-[(E)-2-bromovinyl]-5-hydroxy-2-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]hexa-2,4-dienamide
Wiley ID 1530605