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naphtho[2',3':7,8]cyclodeca[1,2,3,4-def]biphenylene
SpectraBase Compound ID 1EdFJ2jhgsj
InChI InChI=1S/C26H16/c1-2-6-20-16-22-14-12-18-8-4-10-24-23-9-3-7-17(25(23)26(18)24)11-13-21(22)15-19(20)5-1/h1-16H/b13-11-,14-12-,17-11-,18-12-,21-13-,22-14-
InChIKey XTXLJNGFHZNDDF-AMMRDUNDSA-N
Mol Weight 328.41 g/mol
Molecular Formula C26H16
Exact Mass 328.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EDtarhFjZqn
Name naphtho[2',3':7,8]cyclodeca[1,2,3,4-def]biphenylene
CAS Registry Number 100229-98-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H16
InChI InChI=1S/C26H16/c1-2-6-20-16-22-14-12-18-8-4-10-24-23-9-3-7-17(25(23)26(18)24)11-13-21(22)15-19(20)5-1/h1-16H/b13-11-,14-12-,17-11-,18-12-,21-13-,22-14-
InChIKey XTXLJNGFHZNDDF-AMMRDUNDSA-N
Molecular Weight 328.414 g/mol
SMILES C12=C3\C4=C/C=C\5\C(=C/C=C\2C=CC=C1C3=CC=C4)C=[c]1[c](cccc1)=C5
SPLASH splash10-004i-0109000000-085219258d0cf42d9df8
Source of Spectrum J-51-1093-11
Wiley ID 1326890