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3-Methyl-3H-cyclonona[def]biphenylene
SpectraBase Compound ID bVF8aPY7C4
InChI InChI=1S/C18H14/c1-12-8-10-13-4-2-6-15-16-7-3-5-14(11-9-12)18(16)17(13)15/h2-12H,1H3/b10-8-,11-9-
InChIKey NLTNKIRVEQRERQ-WGEIWTTOSA-N
Mol Weight 230.31 g/mol
Molecular Formula C18H14
Exact Mass 230.10955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7RsxVHaGxa
Name 3-Methyl-3H-cyclonona[def]biphenylene
CAS Registry Number 110823-80-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14
InChI InChI=1S/C18H14/c1-12-8-10-13-4-2-6-15-16-7-3-5-14(11-9-12)18(16)17(13)15/h2-12H,1H3/b10-8-,11-9-
InChIKey NLTNKIRVEQRERQ-WGEIWTTOSA-N
Molecular Weight 230.310 g/mol
SMILES CC1\C=C/c2c-3c(ccc2)-c2cccc(\C=C/1)c32
SPLASH splash10-001i-0090000000-b0ef6bd8b94c103f3571
Source of Spectrum F-42-6397-10
Synonyms (Z,Z)-3-Methyl-3H-cyclonona(def)biphenylene
Wiley ID 1232440