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1,4-bis{bis[4-(2'-Propynyloxy)phenyl]methyl} benzene
SpectraBase Compound ID LP3EbNjpbMw
InChI InChI=1S/C44H34O4/c1-5-29-45-39-21-13-35(14-22-39)43(36-15-23-40(24-16-36)46-30-6-2)33-9-11-34(12-10-33)44(37-17-25-41(26-18-37)47-31-7-3)38-19-27-42(28-20-38)48-32-8-4/h1-4,9-28,43-44H,29-32H2
InChIKey YIFOZRWXQFVDJN-UHFFFAOYSA-N
Mol Weight 626.8 g/mol
Molecular Formula C44H34O4
Exact Mass 626.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHn4PObqiOF
Name 1,4-bis{bis[4-(2'-Propynyloxy)phenyl]methyl} benzene
Alternate Name(s) 1,4-bis{bis[4-(2-propynyloxy)phenyl]methyl}benzene
CAS Registry Number 140149-16-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C44H34O4
InChI InChI=1S/C44H34O4/c1-5-29-45-39-21-13-35(14-22-39)43(36-15-23-40(24-16-36)46-30-6-2)33-9-11-34(12-10-33)44(37-17-25-41(26-18-37)47-31-7-3)38-19-27-42(28-20-38)48-32-8-4/h1-4,9-28,43-44H,29-32H2
InChIKey YIFOZRWXQFVDJN-UHFFFAOYSA-N
Molecular Weight 626.752 g/mol
SMILES C(#C)COc1ccc(C(c2ccc(C(c3ccc(cc3)OCC#C)c3ccc(cc3)OCC#C)cc2)c2ccc(cc2)OCC#C)cc1
SPLASH splash10-004i-0043119000-1f4242e4a9f53f10b59e
Source of Spectrum K-125-1693-7
Wiley ID 1411923