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Endo-benzylindene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Endo-benzylindene
SpectraBase Compound ID BC51QkErkKK
InChI InChI=1S/C23H18O.C6H6/c24-22-20-13-7-6-12-19(20)21-18-11-5-4-10-17(18)15-23(21,22)14-16-8-2-1-3-9-16;1-2-4-6-5-3-1/h1-13,21H,14-15H2;1-6H
InChIKey BYQYIRJOEDOCRC-UHFFFAOYSA-N
Mol Weight 388.51 g/mol
Molecular Formula C29H24O
Exact Mass 388.182715 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D7ZbUWgwfjA
Name Endo-benzylindene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.182715392 u
Formula C29H24O
InChI InChI=1S/C23H18O.C6H6/c24-22-20-13-7-6-12-19(20)21-18-11-5-4-10-17(18)15-23(21,22)14-16-8-2-1-3-9-16;1-2-4-6-5-3-1/h1-13,21H,14-15H2;1-6H
InChIKey BYQYIRJOEDOCRC-UHFFFAOYSA-N
Molecular Weight 388.510 g/mol
Nominal Mass 388 u
SMILES c1ccccc1.c12c(cccc2)C(C2(C1c1c(C2)cccc1)Cc1ccccc1)=O