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5,13-bis(Diethoxymethyl)-4,12-bis(formyl)[2.2]paracyclophane
SpectraBase Compound ID 4QWx73BUH6u
InChI InChI=1S/C28H36O6/c1-5-31-27(32-6-2)25-21-13-9-19(23(25)17-29)12-16-22-14-10-20(11-15-21)24(18-30)26(22)28(33-7-3)34-8-4/h9-10,13-14,17-18,27-28H,5-8,11-12,15-16H2,1-4H3
InChIKey IJUZVUYUKPBDPS-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C28H36O6
Exact Mass 468.251189 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BASKIuCv7ZJ
Name 5,13-bis(Diethoxymethyl)-4,12-bis(formyl)[2.2]paracyclophane
Alternate Name(s) 6,12-bis(diethoxymethyl)tricyclo[8.2.2.2(4,7)]hexadeca-1(12),4,6,10,13,15-hexaene-5,11-dicarbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36O6
InChI InChI=1S/C28H36O6/c1-5-31-27(32-6-2)25-21-13-9-19(23(25)17-29)12-16-22-14-10-20(11-15-21)24(18-30)26(22)28(33-7-3)34-8-4/h9-10,13-14,17-18,27-28H,5-8,11-12,15-16H2,1-4H3
InChIKey IJUZVUYUKPBDPS-UHFFFAOYSA-N
Molecular Weight 468.590 g/mol
SMILES c1(c(c2CCc3c(c(c(CCc1cc2)cc3)C=O)C(OCC)OCC)C=O)C(OCC)OCC
SPLASH splash10-0gi3-0745900000-0324c5bd0053f124024f
Source of Spectrum K1-2000-2700-5
Wiley ID 750017