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Cyclobuta[a]dibenzo[c,f]cyclohepta-3,6-diene
SpectraBase Compound ID BQx3Z3quyXY
InChI InChI=1S/C17H16/c1-3-7-14-12(5-1)11-13-6-2-4-8-15(13)17-10-9-16(14)17/h1-8,16-17H,9-11H2
InChIKey GGWUVRIFZPZCIX-UHFFFAOYSA-N
Mol Weight 220.31 g/mol
Molecular Formula C17H16
Exact Mass 220.125201 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5bkLSPRzTaj
Name Cyclobuta[a]dibenzo[c,f]cyclohepta-3,6-diene
CAS Registry Number 61857-12-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16
InChI InChI=1S/C17H16/c1-3-7-14-12(5-1)11-13-6-2-4-8-15(13)17-10-9-16(14)17/h1-8,16-17H,9-11H2
InChIKey GGWUVRIFZPZCIX-UHFFFAOYSA-N
Molecular Weight 220.315 g/mol
SMILES c1cc2c(cc1)Cc1c(C3C2CC3)cccc1
SPLASH splash10-014i-2910000000-5831ed56a10105d4caa4
Synonyms 2,2a,7,11b-Tetrahydro-1H-dibenzo[a,E]cyclobuta[c]cycloheptene
Wiley ID 1475604