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2-Propen-1-one, 3-phenyl-1-[3,4,5,6-tetrahydro-7,9-dimethoxy-2-methyl-5-(1-methylethy lidene)-2,6-methano-2H-1-benzoxocin-10-yl]-, (E)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

2-Propen-1-one, 3-phenyl-1-[3,4,5,6-tetrahydro-7,9-dimethoxy-2-methyl-5-(1-methylethy lidene)-2,6-methano-2H-1-benzoxocin-10-yl]-, (E)-(.+-.)-
SpectraBase Compound ID 6oN9Lq3FS2l
InChI InChI=1S/C27H30O4/c1-17(2)19-13-14-27(3)16-20(19)24-22(29-4)15-23(30-5)25(26(24)31-27)21(28)12-11-18-9-7-6-8-10-18/h6-12,15,20H,13-14,16H2,1-5H3/b12-11+
InChIKey CARSFYCDJSLPFY-VAWYXSNFSA-N
Mol Weight 418.53 g/mol
Molecular Formula C27H30O4
Exact Mass 418.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bf3vVgBd6Ur
Name 2-Propen-1-one, 3-phenyl-1-[3,4,5,6-tetrahydro-7,9-dimethoxy-2-methyl-5-(1-methylethy lidene)-2,6-methano-2H-1-benzoxocin-10-yl]-, (E)-(.+-.)-
CAS Registry Number 81943-61-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H30O4
InChI InChI=1S/C27H30O4/c1-17(2)19-13-14-27(3)16-20(19)24-22(29-4)15-23(30-5)25(26(24)31-27)21(28)12-11-18-9-7-6-8-10-18/h6-12,15,20H,13-14,16H2,1-5H3/b12-11+
InChIKey CARSFYCDJSLPFY-VAWYXSNFSA-N
Molecular Weight 418.533 g/mol
SMILES c12c(C3C(=C(C)C)CCC(O2)(C3)C)c(OC)cc(c1C(\C=C\c1ccccc1)=O)OC
SPLASH splash10-001i-9004100000-3a1d2dd59206683c81fe
Source of Spectrum B-35-358-0
Synonyms (+,-)-(E)-1-(5'-isopropylidene-7',9'-dimethoxy-2'-methyl-3',4',5',6'-tetrahydro-2',6'-methano-2'H-1'-benzoxocin-10'-yl)-3-phenylprop-2-en-1-one (2E)-1-[3,5-dimethoxy-9-methyl-12-(1-methylethylidene)-8-oxatricyclo[7.3.1.0(2,7)]trideca-2,4,6-trien-6-yl]-3-phenyl-2-propen-1-one 2,6-Methano-2H-1-benzoxocin, 2-propen-1-one deriv.
Wiley ID 1377426