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4,4'-Biphenylene-bis(3''-phenyl-1''-isobenzofuran)
SpectraBase Compound ID 4tWEK0CSYGV
InChI InChI=1S/C40H26O2/c1-5-15-27(16-6-1)31-23-13-25-33-35(31)37(29-19-9-3-10-20-29)41-39(33)40-34-26-14-24-32(28-17-7-2-8-18-28)36(34)38(42-40)30-21-11-4-12-22-30/h1-26H
InChIKey VROITUUFOQWKSY-UHFFFAOYSA-N
Mol Weight 538.6 g/mol
Molecular Formula C40H26O2
Exact Mass 538.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1T1l47glW3E
Name 4,4'-Biphenylene-bis(3''-phenyl-1''-isobenzofuran)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C40H26O2
InChI InChI=1S/C40H26O2/c1-5-15-27(16-6-1)31-23-13-25-33-35(31)37(29-19-9-3-10-20-29)41-39(33)40-34-26-14-24-32(28-17-7-2-8-18-28)36(34)38(42-40)30-21-11-4-12-22-30/h1-26H
InChIKey VROITUUFOQWKSY-UHFFFAOYSA-N
Molecular Weight 538.646 g/mol
SMILES c1(-c2c3c(c(-c4ccccc4)ccc3)c(o2)-c2ccccc2)c2c(c(-c3ccccc3)ccc2)c(o1)-c1ccccc1
SPLASH splash10-000i-4122090000-5c93db2df7f6c47acd2d
Source of Spectrum I-87-742-3c
Wiley ID 1691702