For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

3,3',6,6'-tetra(t-butyl)-1,1'-binaphthyl

View entire compound with spectra: 1 MS (GC)

3,3',6,6'-tetra(t-butyl)-1,1'-binaphthyl
SpectraBase Compound ID 8FnHkVpQWwP
InChI InChI=1S/C36H46/c1-33(2,3)25-13-15-29-23(17-25)19-27(35(7,8)9)21-31(29)32-22-28(36(10,11)12)20-24-18-26(34(4,5)6)14-16-30(24)32/h13-22H,1-12H3
InChIKey OKMYJVRPXYPCOM-UHFFFAOYSA-N
Mol Weight 478.8 g/mol
Molecular Formula C36H46
Exact Mass 478.359951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID KSkpwtEGNsT
Name 3,3',6,6'-tetra(t-butyl)-1,1'-binaphthyl
Alternate Name(s) 3,6-di-tert-butyl-1-(3,6-di-tert-butylnaphthalen-1-yl)naphthalene 3,6-ditert-butyl-1-(3,6-ditert-butyl-1-naphthalenyl)naphthalene 3,6-ditert-butyl-1-(3,6-ditert-butylnaphthalen-1-yl)naphthalene
CAS Registry Number 126822-81-9
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H46
InChI InChI=1S/C36H46/c1-33(2,3)25-13-15-29-23(17-25)19-27(35(7,8)9)21-31(29)32-22-28(36(10,11)12)20-24-18-26(34(4,5)6)14-16-30(24)32/h13-22H,1-12H3
InChIKey OKMYJVRPXYPCOM-UHFFFAOYSA-N
Molecular Weight 478.764 g/mol
SMILES c1(-c2c3c(cc(cc3)C(C)(C)C)cc(c2)C(C)(C)C)c2c(cc(cc2)C(C)(C)C)cc(c1)C(C)(C)C
SPLASH splash10-056r-8000900000-06e0e49635e22dd547fc
Source of Spectrum K-124-2096-6
Wiley ID 1394933