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1,2,17,17-Tetramethyl-16-oxo-[2.1.2.1]paracyclophane-1-ene
SpectraBase Compound ID 5Hnz2GEjU5g
InChI InChI=1S/C34H32O/c1-23-24(2)30-15-7-26(8-16-30)22-28-11-19-32(20-12-28)34(3,4)33(35)31-17-9-27(10-18-31)21-25-5-13-29(23)14-6-25/h5-20H,21-22H2,1-4H3/b24-23-
InChIKey SJMRRWFEIDASRP-VHXPQNKSSA-N
Mol Weight 456.6 g/mol
Molecular Formula C34H32O
Exact Mass 456.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AbiNh0U7mvt
Name 1,2,17,17-Tetramethyl-16-oxo-[2.1.2.1]paracyclophane-1-ene
Alternate Name(s) 8,8,18,19-tetramethylpentacyclo[18.2.2.2(3,6).2(9,12).2(14,17)]triaconta-1(22),3,5,9,11,14,16,18,20,23,25,27,29-tridecaen-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H32O
InChI InChI=1S/C34H32O/c1-23-24(2)30-15-7-26(8-16-30)22-28-11-19-32(20-12-28)34(3,4)33(35)31-17-9-27(10-18-31)21-25-5-13-29(23)14-6-25/h5-20H,21-22H2,1-4H3/b24-23-
InChIKey SJMRRWFEIDASRP-VHXPQNKSSA-N
Molecular Weight 456.629 g/mol
SMILES c12\C(=C/(c3ccc(Cc4ccc(C(C(c5ccc(Cc(cc2)cc1)cc5)=O)(C)C)cc4)cc3)C)C
SPLASH splash10-0btc-1330900000-383e1368c47b628d7cc7
Source of Spectrum K-127-1165-14
Wiley ID 1389566