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Bicyclo[9.2.2]pentadeca-5,6,11,13,14-pentaene
SpectraBase Compound ID 9ScYRcbOfl4
InChI InChI=1S/C15H18/c1-2-4-6-8-14-10-12-15(13-11-14)9-7-5-3-1/h2-3,10-13H,4-9H2
InChIKey MLKMMNWQHKYSRO-UHFFFAOYSA-N
Mol Weight 198.31 g/mol
Molecular Formula C15H18
Exact Mass 198.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EaNMwjjYJrJ
Name Bicyclo[9.2.2]pentadeca-5,6,11,13,14-pentaene
CAS Registry Number 89507-15-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18
InChI InChI=1S/C15H18/c1-2-4-6-8-14-10-12-15(13-11-14)9-7-5-3-1/h2-3,10-13H,4-9H2
InChIKey MLKMMNWQHKYSRO-UHFFFAOYSA-N
Molecular Weight 198.309 g/mol
SMILES C1=C=CCCCc2ccc(CCC1)cc2
SPLASH splash10-05r4-0900000000-d5f8ce6cc16e921a7b2c
Source of Spectrum K-117-485-0
Synonyms bicyclo[9.2.2]pentadeca-1(13),5,6,11,14-pentaene [9]paracyclophan-4,5-diene
Wiley ID 1196405