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3-Methyleneverbanone
SpectraBase Compound ID B4pZiYAiOzq
InChI InChI=1S/C11H16O/c1-6-7(2)10(12)9-5-8(6)11(9,3)4/h6,8-9H,2,5H2,1,3-4H3/t6?,8-,9+/m1/s1
InChIKey LMRMWOUYNIJQOB-UOWBCLSMSA-N
Mol Weight 164.25 g/mol
Molecular Formula C11H16O
Exact Mass 164.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUBCuqzXMRj
Name 3-Methyleneverbanone
Comments Removed - expert review: contamination (acetone))
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c1-6-7(2)10(12)9-5-8(6)11(9,3)4/h6,8-9H,2,5H2,1,3-4H3/t6?,8-,9+/m1/s1
InChIKey LMRMWOUYNIJQOB-UOWBCLSMSA-N
Molecular Weight 164.248 g/mol
SMILES [C@@]12(C(C(=C)C([C@@](C2)(C1(C)C)[H])C)=O)[H]
SPLASH splash10-0a4i-9000000000-93700313597852fe07b5
Source of Spectrum O1-36-792-12
Synonyms 4,6,6-trimethyl-3-methylenebicyclo[3.1.1]heptan-2-one
Wiley ID 819832