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trans-3-(3-Bromophenyl)-4-Carbethoxy-2,3-dihydro-2-fur-2'-oyl-5-methylfuran
SpectraBase Compound ID 6P1XTEMPduw
InChI InChI=1S/C19H17BrO5/c1-3-23-19(22)15-11(2)25-18(17(21)14-8-5-9-24-14)16(15)12-6-4-7-13(20)10-12/h4-10,16,18H,3H2,1-2H3/t16-,18-/m1/s1
InChIKey NQPATRJZQDDPNW-SJLPKXTDSA-N
Mol Weight 405.24 g/mol
Molecular Formula C19H17BrO5
Exact Mass 404.025937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JWbLRAEq2h
Name trans-3-(3-Bromophenyl)-4-Carbethoxy-2,3-dihydro-2-fur-2'-oyl-5-methylfuran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17BrO5
InChI InChI=1S/C19H17BrO5/c1-3-23-19(22)15-11(2)25-18(17(21)14-8-5-9-24-14)16(15)12-6-4-7-13(20)10-12/h4-10,16,18H,3H2,1-2H3/t16-,18-/m1/s1
InChIKey NQPATRJZQDDPNW-SJLPKXTDSA-N
Literature Reference DOI 10.1002/cjoc.200790188
Molecular Weight 405.244 g/mol
SMILES c1oc(cc1)C([C@]1([C@@](C(=C(O1)C)C(OCC)=O)(c1cccc(c1)Br)[H])[H])=O
SPLASH splash10-0002-9016100000-74166e62e7ed48ca92b4
Source of Spectrum CJC-25-971-3i
Synonyms (4R,5R)-ethyl 4-(3-bromophenyl)-5-(furan-2-carbonyl)-2-methyl-4,5-dihydrofuran-3-carboxylate
Wiley ID 1774464