trans-1-Adamantyl-1-(4-chlorophenyl)-1,2-dihydronaphtho[2,1-b]furan-2-ylmethanone

SpectraBase Compound ID	1wMvhCaCfDQ
InChI	InChI=1S/C29H27ClO2/c30-22-8-5-21(6-9-22)25-26-23-4-2-1-3-20(23)7-10-24(26)32-27(25)28(31)29-14-17-11-18(15-29)13-19(12-17)16-29/h1-10,17-19,25,27H,11-16H2/t17-,18?,19?,25-,27-,29?/m0/s1
InChIKey	IBDUOGDNLAYHQN-HLPIIRETSA-N Google Search
Mol Weight	442.99 g/mol
Molecular Formula	C29H27ClO2
Exact Mass	442.169958 g/mol

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SpectraBase Spectrum ID	ZsOZ9eOB6
Name	trans-1-Adamantyl-1-(4-chlorophenyl)-1,2-dihydronaphtho[2,1-b]furan-2-ylmethanone
Alternate Name(s)	(3R,5R)-adamantan-1-yl((1S,2S)-1-(4-chlorophenyl)-1,2-dihydronaphtho[2,1-b]furan-2-yl)methanone 1-Adamantyl-[(1S,2S)-1-(4-chlorophenyl)-1,2-dihydrobenzo[e][1]benzofuran-2-yl]methanone
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C29H27ClO2
InChI	InChI=1S/C29H27ClO2/c30-22-8-5-21(6-9-22)25-26-23-4-2-1-3-20(23)7-10-24(26)32-27(25)28(31)29-14-17-11-18(15-29)13-19(12-17)16-29/h1-10,17-19,25,27H,11-16H2/t17-,18?,19?,25-,27-,29?/m0/s1
InChIKey	IBDUOGDNLAYHQN-HLPIIRETSA-N
Literature Reference DOI	10.1021/jo400621r
Molecular Weight	442.986 g/mol
SMILES	C1C2(CC3CC1CC(C3)C2)C([C@]1(Oc2ccc3ccccc3c2[C@@]1(c1ccc(cc1)Cl)[H])[H])=O
SPLASH	splash10-066r-3698000000-1fcea83568b787d5012d
Source of Spectrum	J-78-5514-3q
Wiley ID	1745491