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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]-5-cyclohexyl-penta-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]-5-cyclohexyl-penta-2,4-dienamide
SpectraBase Compound ID Jjfh6jFLlC3
InChI InChI=1S/C19H22BrNO4/c20-11-10-19(24)12-14(16(23)17-18(19)25-17)21-15(22)9-5-4-8-13-6-2-1-3-7-13/h4-5,8-13,17-18,24H,1-3,6-7H2,(H,21,22)/b8-4+,9-5+,11-10+/t17-,18-,19+/m0/s1
InChIKey QCQVSRQQDQQMJI-OZHGBNMTSA-N
Mol Weight 408.29 g/mol
Molecular Formula C19H22BrNO4
Exact Mass 407.073221 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71EIUw74iZ1
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]-5-cyclohexyl-penta-2,4-dienamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22BrNO4
InChI InChI=1S/C19H22BrNO4/c20-11-10-19(24)12-14(16(23)17-18(19)25-17)21-15(22)9-5-4-8-13-6-2-1-3-7-13/h4-5,8-13,17-18,24H,1-3,6-7H2,(H,21,22)/b8-4+,9-5+,11-10+/t17-,18-,19+/m0/s1
InChIKey QCQVSRQQDQQMJI-OZHGBNMTSA-N
Molecular Weight 408.292 g/mol
SMILES O[C@]1([C@@]2([C@](C(C(=C1)NC(\C=C\C=C\C1CCCCC1)=O)=O)(O2)[H])[H])\C=C\Br
SPLASH splash10-0ul0-0090000000-fb8cb6534df4ae53c320
Source of Spectrum J-64-5060-32
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]-5-cyclohexylpenta-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]-5-cyclohexyl-penta-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]-5-cyclohexyl-penta-2,4-dienamide
Wiley ID 1530601