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5,6,7,8-Tetrahydro-1,2,3,4-tetraphenylbenzocyclooctene
SpectraBase Compound ID EemTMPnTRO3
InChI InChI=1S/C36H30/c1-2-16-26-32-31(25-15-1)33(27-17-7-3-8-18-27)35(29-21-11-5-12-22-29)36(30-23-13-6-14-24-30)34(32)28-19-9-4-10-20-28/h3-15,17-25H,1-2,16,26H2/b25-15-
InChIKey ZGSMUFMGTKYFGR-MYYYXRDXSA-N
Mol Weight 462.6 g/mol
Molecular Formula C36H30
Exact Mass 462.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Addq4RqxrQg
Name 5,6,7,8-Tetrahydro-1,2,3,4-tetraphenylbenzocyclooctene
Alternate Name(s) (Z)-1,2,3,4-tetraphenyl-5,6,7,8-tetrahydrobenzo[8]annulene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H30
InChI InChI=1S/C36H30/c1-2-16-26-32-31(25-15-1)33(27-17-7-3-8-18-27)35(29-21-11-5-12-22-29)36(30-23-13-6-14-24-30)34(32)28-19-9-4-10-20-28/h3-15,17-25H,1-2,16,26H2/b25-15-
InChIKey ZGSMUFMGTKYFGR-MYYYXRDXSA-N
Molecular Weight 462.636 g/mol
SMILES C1\C=C/c2c(CCC1)c(c(c(c2-c1ccccc1)-c1ccccc1)-c1ccccc1)-c1ccccc1
SPLASH splash10-03di-0001900000-7de700b771fc92feea3a
Source of Spectrum K-113-2392-12
Wiley ID 1792766