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1,4-Dinaphthafurophane
SpectraBase Compound ID MLldATLflS
InChI InChI=1S/C54H56O4/c1-49(2)37-21-22-38(34-18-14-13-17-33(34)37)50(3,4)42-27-31-47(57-42)54(11,12)48-32-28-44(58-48)52(7,8)40-24-23-39(35-19-15-16-20-36(35)40)51(5,6)43-26-30-46(56-43)53(9,10)45-29-25-41(49)55-45/h13-32H,1-12H3
InChIKey HEANVCPQAJNGBN-UHFFFAOYSA-N
Mol Weight 769.0 g/mol
Molecular Formula C54H56O4
Exact Mass 768.41786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7w27jn6hlA8
Name 1,4-Dinaphthafurophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H56O4
InChI InChI=1S/C54H56O4/c1-49(2)37-21-22-38(34-18-14-13-17-33(34)37)50(3,4)42-27-31-47(57-42)54(11,12)48-32-28-44(58-48)52(7,8)40-24-23-39(35-19-15-16-20-36(35)40)51(5,6)43-26-30-46(56-43)53(9,10)45-29-25-41(49)55-45/h13-32H,1-12H3
InChIKey HEANVCPQAJNGBN-UHFFFAOYSA-N
Molecular Weight 769.038 g/mol
SMILES c12C(c3oc(C(c4c5c(cccc5)c(C(c5oc(C(c6oc(C(c7ccc(C(c(o1)cc2)(C)C)c1c7cccc1)(C)C)cc6)(C)C)cc5)(C)C)cc4)(C)C)cc3)(C)C
SPLASH splash10-0uxr-0000000900-1c3aff9bf59d22469b57
Source of Spectrum QE-5-366-9
Wiley ID 843910