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Cyclobuta[b]naphthalen-1(2H)-one
SpectraBase Compound ID Cyg5noIkOGb
InChI InChI=1S/C12H8O/c13-12-7-10-5-8-3-1-2-4-9(8)6-11(10)12/h1-6H,7H2
InChIKey LMTDHJHXWQQJET-UHFFFAOYSA-N
Mol Weight 168.19 g/mol
Molecular Formula C12H8O
Exact Mass 168.057515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 783cr0pUaEL
Name Cyclobuta[b]naphthalen-1(2H)-one
CAS Registry Number 89185-31-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O
InChI InChI=1S/C12H8O/c13-12-7-10-5-8-3-1-2-4-9(8)6-11(10)12/h1-6H,7H2
InChIKey LMTDHJHXWQQJET-UHFFFAOYSA-N
Molecular Weight 168.195 g/mol
SMILES c12c(cc3c(c2)cccc3)CC1=O
SPLASH splash10-014u-1900000000-60a78ed7bdcee05c578b
Source of Spectrum H-72-1623-2
Wiley ID 1165354