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3-Formyl-(syn)-[2.2]-(1,6)-Azulenophane
SpectraBase Compound ID GWQ3OYtkswj
InChI InChI=1S/C25H20O/c26-16-25-22-5-3-1-2-4-21(22)23-12-8-17-6-10-19-14-18(9-13-24(23)25)15-20(19)11-7-17/h1-7,10-11,14-16H,8-9,12-13H2
InChIKey XDCWYZROZVYMDK-UHFFFAOYSA-N
Mol Weight 336.43 g/mol
Molecular Formula C25H20O
Exact Mass 336.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DlohzyUPbcF
Name 3-Formyl-(syn)-[2.2]-(1,6)-Azulenophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H20O
InChI InChI=1S/C25H20O/c26-16-25-22-5-3-1-2-4-21(22)23-12-8-17-6-10-19-14-18(9-13-24(23)25)15-20(19)11-7-17/h1-7,10-11,14-16H,8-9,12-13H2
InChIKey XDCWYZROZVYMDK-UHFFFAOYSA-N
Molecular Weight 336.434 g/mol
SMILES c12c(c(C=O)c3c2ccccc3)CCc2cc3ccc(CC1)ccc3c2
SPLASH splash10-0udi-0901000000-21242d8000a7ff45f08c
Source of Spectrum U1-1998-433-29
Synonyms Pentacyclo[16.3.2.1(3,21).0(6,15).0(8,14)]tetracosa-1,3(24),6(15),7,9,11,13,18,20,22-decaene-7-carbaldehyde
Wiley ID 750872