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(3aS,6aS)-3,6-dibenzyl-1,3a,4,6a-tetrahydropentalene
SpectraBase Compound ID C6YC5vfLqp8
InChI InChI=1S/C22H22/c1-3-7-17(8-4-1)15-19-11-13-22-20(12-14-21(19)22)16-18-9-5-2-6-10-18/h1-12,21-22H,13-16H2/t21-,22-/m1/s1
InChIKey HCVKKQGUDHPOBX-FGZHOGPDSA-N
Mol Weight 286.42 g/mol
Molecular Formula C22H22
Exact Mass 286.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43G9rIg7AO0
Name (3aS,6aS)-3,6-dibenzyl-1,3a,4,6a-tetrahydropentalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22
InChI InChI=1S/C22H22/c1-3-7-17(8-4-1)15-19-11-13-22-20(12-14-21(19)22)16-18-9-5-2-6-10-18/h1-12,21-22H,13-16H2/t21-,22-/m1/s1
InChIKey HCVKKQGUDHPOBX-FGZHOGPDSA-N
Literature Reference DOI 10.1002/asia.200800049
Molecular Weight 286.418 g/mol
SMILES c1(ccccc1)CC1=CC[C@]2([C@]1([H])CC=C2Cc1ccccc1)[H]
SPLASH splash10-00kf-9820000000-efb63c704866be5017ef
Source of Spectrum CAJ-3-1515-6f
Synonyms (3aS,6aS)-3,6-bis(phenylmethyl)-1,3a,4,6a-tetrahydropentalene
Wiley ID 1775020