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6b,7,8,9,10,10a-Hexahydro-benzo(3,4)cyclobuta(1,2-C)chromen-6-one
SpectraBase Compound ID 2iLhEDFM8bu
InChI InChI=1S/C15H14O2/c16-15-14-10-6-2-1-5-9(10)13(14)11-7-3-4-8-12(11)17-15/h3-4,7-10H,1-2,5-6H2
InChIKey HCMQORGKEOIUNN-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C15H14O2
Exact Mass 226.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kl94xFNnUNO
Name 6H-Benzo[b]benzo[3,4]cyclobuta[1,2-d]pyran-6-one, 6b,7,8,9,10,10a-hexahydro-
Alternate Name(s) 6b,7,8,9,10,10a-hexahydro-6H-benzo[3,4]cyclobuta[1,2-c]chromen-6-one 7,8,9,10-Tetrahydrocycloocta[c]chroman-6-one
CAS Registry Number 57147-64-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O2
InChI InChI=1S/C15H14O2/c16-15-14-10-6-2-1-5-9(10)13(14)11-7-3-4-8-12(11)17-15/h3-4,7-10H,1-2,5-6H2
InChIKey HCMQORGKEOIUNN-UHFFFAOYSA-N
Molecular Weight 226.275 g/mol
SMILES C12=C(c3ccccc3OC2=O)C2C1CCCC2
SPLASH splash10-002b-0970000000-f6b8b8938a9ad905736f
Source of Spectrum KC-1977-2461-0
Wiley ID 1228005