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13.beta.-Ethyl-3-methoxy-17-phenyl-1,3,5(10),14(15),16(17)-gonapentaene
SpectraBase Compound ID KeBbhx4swAa
InChI InChI=1S/C26H28O/c1-3-26-16-15-22-21-12-10-20(27-2)17-19(21)9-11-23(22)25(26)14-13-24(26)18-7-5-4-6-8-18/h4-8,10,12-14,17,22-23H,3,9,11,15-16H2,1-2H3/t22-,23-,26-/m1/s1
InChIKey JQMPCEOYVALMBL-JQYIIUTOSA-N
Mol Weight 356.51 g/mol
Molecular Formula C26H28O
Exact Mass 356.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FTCb8hoFDn
Name 13.beta.-Ethyl-3-methoxy-17-phenyl-1,3,5(10),14(15),16(17)-gonapentaene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28O
InChI InChI=1S/C26H28O/c1-3-26-16-15-22-21-12-10-20(27-2)17-19(21)9-11-23(22)25(26)14-13-24(26)18-7-5-4-6-8-18/h4-8,10,12-14,17,22-23H,3,9,11,15-16H2,1-2H3/t22-,23-,26-/m1/s1
InChIKey JQMPCEOYVALMBL-JQYIIUTOSA-N
Molecular Weight 356.509 g/mol
SMILES [C@@]12(C([C@@]3(CCc4c([C@]3(CC2)[H])ccc(OC)c4)[H])=CC=C1c1ccccc1)CC
SPLASH splash10-0adr-0709000000-2e433ce300a616a8ef76
Source of Spectrum SO-0-816-4
Synonyms (1S,10R,15S)-15-ethyl-5-methoxy-14-phenyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-2(7),3,5,11,13-pentaene 13.alpha.-Ethyl-3-methoxy-17-phenyl-1,3,5(10),14(15),16(17)-gonapentaene
Wiley ID 1540958