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1,2,3,4,9,10-Hexahydro-1,1-dimethyl-4-oxobenz[f]azulene
SpectraBase Compound ID 7mHi5i2OC3g
InChI InChI=1S/C16H18O/c1-16(2)10-9-13-14(16)8-7-11-5-3-4-6-12(11)15(13)17/h3-6H,7-10H2,1-2H3
InChIKey MPJVJKUSTKMAJX-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3THZOXjfzkI
Name 1,2,3,4,9,10-Hexahydro-1,1-dimethyl-4-oxobenz[f]azulene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c1-16(2)10-9-13-14(16)8-7-11-5-3-4-6-12(11)15(13)17/h3-6H,7-10H2,1-2H3
InChIKey MPJVJKUSTKMAJX-UHFFFAOYSA-N
Molecular Weight 226.319 g/mol
SMILES C12=C(C(C)(C)CC2)CCc2c(C1=O)cccc2
SPLASH splash10-03fr-2490000000-3a9a78d07bbea385e6f5
Source of Spectrum F-48-7294-11
Synonyms 1,1-Dimethyl-2,3,9,10-tetrahydrobenzo[f]azulen-4(1H)-one 3,3-Dimethyl-1,2,4,5-tetrahydrobenzo[f]azulen-10-one
Wiley ID 1228238