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2-Benzyl-2,3,6,7-tetrahydro-4,5-benzotropone
SpectraBase Compound ID LJ5OF6r8DkH
InChI InChI=1S/C18H18O/c19-18-11-10-15-8-4-5-9-16(15)13-17(18)12-14-6-2-1-3-7-14/h1-9,17H,10-13H2
InChIKey AXKBHJJEFLKONX-UHFFFAOYSA-N
Mol Weight 250.34 g/mol
Molecular Formula C18H18O
Exact Mass 250.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 69sacShVdTu
Name 2-Benzyl-2,3,6,7-tetrahydro-4,5-benzotropone
Alternate Name(s) 6-Benzyl-5,6,8,9-tetrahydro-7H-benzo[a]cyclohepten-7-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O
InChI InChI=1S/C18H18O/c19-18-11-10-15-8-4-5-9-16(15)13-17(18)12-14-6-2-1-3-7-14/h1-9,17H,10-13H2
InChIKey AXKBHJJEFLKONX-UHFFFAOYSA-N
Molecular Weight 250.341 g/mol
SMILES C1(C(CCc2c(C1)cccc2)=O)Cc1ccccc1
SPLASH splash10-0f7k-0950000000-8d51adac6111748218f6
Source of Spectrum F-69-3423-9
Wiley ID 1595038