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2-[(4-methylphenyl)methylene]-1,3-bis[(E)-phenylmethylene]cyclopentaene
SpectraBase Compound ID CUs2A7JMWER
InChI InChI=1S/C27H24/c1-21-12-14-24(15-13-21)20-27-25(18-22-8-4-2-5-9-22)16-17-26(27)19-23-10-6-3-7-11-23/h2-15,18-20H,16-17H2,1H3/b25-18-,26-19+,27-20-
InChIKey RKTPLWQOEMXUAD-CUVRBDJFSA-N
Mol Weight 348.49 g/mol
Molecular Formula C27H24
Exact Mass 348.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 84kB3QF9SOx
Name 2-[(4-methylphenyl)methylene]-1,3-bis[(E)-phenylmethylene]cyclopentaene
Alternate Name(s) 1-{[(2Z,5E)-2,5-dibenzylidenecyclopentylidene]methyl}-4-methylbenzene
CAS Registry Number 115591-89-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H24
InChI InChI=1S/C27H24/c1-21-12-14-24(15-13-21)20-27-25(18-22-8-4-2-5-9-22)16-17-26(27)19-23-10-6-3-7-11-23/h2-15,18-20H,16-17H2,1H3/b25-18-,26-19+,27-20-
InChIKey RKTPLWQOEMXUAD-CUVRBDJFSA-N
Molecular Weight 348.489 g/mol
SMILES c1(\C=C\2\C(\C(CC2)=C/c2ccccc2)=C\c2ccc(cc2)C)ccccc1
SPLASH splash10-0a4i-5691000000-10f472e6fb83bdf51150
Source of Spectrum K-121-2130-3
Wiley ID 1341193