John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=5jvi7PjYD16 SpectraBase Spectrum ID=D1ZNuOzDD7o

(accessed ).
TETRACYCLO[6.1.0.0E2,4.0E5,7]NONANE, 3,3,6,6,9,9-HEXAPHENYL-, cis,cis,trans
SpectraBase Compound ID 5jvi7PjYD16
InChI InChI=1S/C32H28.C13H12/c1-5-13-23(14-6-1)31(24-15-7-2-8-16-24)27-21-22-28-30(29(27)31)32(28,25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-20,27-30H,21-22H2;1-10H,11H2
InChIKey BZPCOZIMDOPBKV-UHFFFAOYSA-N
Mol Weight 580.8 g/mol
Molecular Formula C45H40
Exact Mass 580.313001 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID D1ZNuOzDD7o
Name TETRACYCLO[6.1.0.0E2,4.0E5,7]NONANE, 3,3,6,6,9,9-HEXAPHENYL-, cis,cis,trans
Copyright Copyright © 2002-2020 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C45H36
InChI InChI=1S/C32H28.C13H12/c1-5-13-23(14-6-1)31(24-15-7-2-8-16-24)27-21-22-28-30(29(27)31)32(28,25-17-9-3-10-18-25)26-19-11-4-12-20-26;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1-20,27-30H,21-22H2;1-10H,11H2
InChIKey BZPCOZIMDOPBKV-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 580.3120
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
SpectraBase Batch ID GVZlICjSKFe