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trans-1-Adamantyl-1-(2-thienyl)-1,2-dihydronaphtho[2,1-b]-furan-2-ylmethanone
SpectraBase Compound ID 9y1qTxxBI6r
InChI InChI=1S/C27H26O2S/c28-26(27-13-16-10-17(14-27)12-18(11-16)15-27)25-24(22-6-3-9-30-22)23-20-5-2-1-4-19(20)7-8-21(23)29-25/h1-9,16-18,24-25H,10-15H2/t16-,17?,18?,24-,25-,27?/m0/s1
InChIKey UOEPXIUWFRAXMZ-KJPZNFMHSA-N
Mol Weight 414.56 g/mol
Molecular Formula C27H26O2S
Exact Mass 414.165351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H4mZNP1R7OP
Name trans-1-Adamantyl-1-(2-thienyl)-1,2-dihydronaphtho[2,1-b]-furan-2-ylmethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H26O2S
InChI InChI=1S/C27H26O2S/c28-26(27-13-16-10-17(14-27)12-18(11-16)15-27)25-24(22-6-3-9-30-22)23-20-5-2-1-4-19(20)7-8-21(23)29-25/h1-9,16-18,24-25H,10-15H2/t16-,17?,18?,24-,25-,27?/m0/s1
InChIKey UOEPXIUWFRAXMZ-KJPZNFMHSA-N
Literature Reference DOI 10.1021/jo400621r
Molecular Weight 414.563 g/mol
SMILES C1C2CC3CC1(CC(C2)C3)C([C@]1(Oc2ccc3ccccc3c2[C@@]1(c1cccs1)[H])[H])=O
SPLASH splash10-004i-2390000000-e84e854e62ef54c09192
Source of Spectrum J-78-5515-3u
Synonyms (3R,5R)-adamantan-1-yl((1S,2S)-1-(thiophen-2-yl)-1,2-dihydronaphtho[2,1-b]furan-2-yl)methanone 1-Adamantyl-[(1S,2S)-1-thiophen-2-yl-1,2-dihydrobenzo[e]benzofuran-2-yl]methanone 1-Adamantyl-[(1S,2S)-1-thiophen-2-yl-1,2-dihydrobenzo[e][1]benzofuran-2-yl]methanone
Wiley ID 1745492