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1,3-Dinaphthafurophane
SpectraBase Compound ID 7LA0RfBnMB1
InChI InChI=1S/C54H56O4/c1-49(2)37-21-23-39(35-19-15-13-17-33(35)37)51(5,6)43-27-29-45(56-43)53(9,10)47-31-32-48(58-47)54(11,12)46-30-28-44(57-46)52(7,8)40-24-22-38(34-18-14-16-20-36(34)40)50(3,4)42-26-25-41(49)55-42/h13-32H,1-12H3
InChIKey HCWZTLDRFDLVSW-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 cmOFdYdai
Name 1,3-Dinaphthafurophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C54H56O4
InChI InChI=1S/C54H56O4/c1-49(2)37-21-23-39(35-19-15-13-17-33(35)37)51(5,6)43-27-29-45(56-43)53(9,10)47-31-32-48(58-47)54(11,12)46-30-28-44(57-46)52(7,8)40-24-22-38(34-18-14-16-20-36(34)40)50(3,4)42-26-25-41(49)55-42/h13-32H,1-12H3
InChIKey HCWZTLDRFDLVSW-UHFFFAOYSA-N
Molecular Weight 769.038 g/mol
SMILES c12C(c3oc(C(c4oc(C(c5c6c(cccc6)c(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 splash10-0udj-0200000900-1c54eb237a61f013442f
Source of Spectrum QE-5-366-8
Wiley ID 843911