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(2E)-4-{1-[(tert-Butyl)carbamoyl]cyclohexyl}-2-[(tert-butyl)imino]-5-oxo-2,5-dihydrofuran-3-yl 4-Bromobenzoate
SpectraBase Compound ID K6iL10YJmxx
InChI InChI=1S/C26H33BrN2O5/c1-24(2,3)28-20-19(33-21(30)16-10-12-17(27)13-11-16)18(22(31)34-20)26(14-8-7-9-15-26)23(32)29-25(4,5)6/h10-13H,7-9,14-15H2,1-6H3,(H,29,32)/b28-20+
InChIKey VBYXZGFMDZEHOB-VFCFBJKWSA-N
Mol Weight 533.5 g/mol
Molecular Formula C26H33BrN2O5
Exact Mass 532.157285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DrKzc4q0qJL
Name (2E)-4-{1-[(tert-Butyl)carbamoyl]cyclohexyl}-2-[(tert-butyl)imino]-5-oxo-2,5-dihydrofuran-3-yl 4-Bromobenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H33BrN2O5
InChI InChI=1S/C26H33BrN2O5/c1-24(2,3)28-20-19(33-21(30)16-10-12-17(27)13-11-16)18(22(31)34-20)26(14-8-7-9-15-26)23(32)29-25(4,5)6/h10-13H,7-9,14-15H2,1-6H3,(H,29,32)/b28-20+
InChIKey VBYXZGFMDZEHOB-VFCFBJKWSA-N
Literature Reference DOI 10.1002/hlca.201000359
Molecular Weight 533.463 g/mol
SMILES N(C(C)(C)C)C(C1(C2=C(OC(c3ccc(cc3)Br)=O)\C(OC2=O)=N/C(C)(C)C)CCCCC1)=O
SPLASH splash10-001i-1900000000-38cb563a8dea0dfa912d
Source of Spectrum H-94-1810-4j
Synonyms (E)-4-(1-(tert-butylcarbamoyl)cyclohexyl)-2-(tert-butylimino)-5-oxo-2,5-dihydrofuran-3-yl 4-bromobenzoate
Wiley ID 1785889