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(S)-endo-6-tert-butyl-2-phenylbicyclo[3.2.1]oct-2-en-8-one
SpectraBase Compound ID 7fNoSN0U3VD
InChI InChI=1S/C18H22O/c1-18(2,3)16-11-15-13(9-10-14(16)17(15)19)12-7-5-4-6-8-12/h4-9,14-16H,10-11H2,1-3H3/t14-,15-,16-/m0/s1
InChIKey JDLKLGWRCJPSIR-JYJNAYRXSA-N
Mol Weight 254.37 g/mol
Molecular Formula C18H22O
Exact Mass 254.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JxY3J9inluq
Name (S)-endo-6-tert-butyl-2-phenylbicyclo[3.2.1]oct-2-en-8-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O
InChI InChI=1S/C18H22O/c1-18(2,3)16-11-15-13(9-10-14(16)17(15)19)12-7-5-4-6-8-12/h4-9,14-16H,10-11H2,1-3H3/t14-,15-,16-/m0/s1
InChIKey JDLKLGWRCJPSIR-JYJNAYRXSA-N
Molecular Weight 254.373 g/mol
SMILES [C@]12(C([C@]([C@](C2)(C(C)(C)C)[H])(CC=C1c1ccccc1)[H])=O)[H]
SPLASH splash10-0ik9-0690000000-4b6f9f80074854f8ad1f
Source of Spectrum SO-0-493-10
Synonyms (6S)-6-tert-butyl-2-phenylbicyclo[3.2.1]oct-2-en-8-one endo-6-tert-butyl-2-phenylbicyclo[3.2.1]oct-2-en-8-one
Wiley ID 873586