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(1S,4R)-4,7,7-trimethyl-3-methylene-2-bicyclo[2.2.1]heptanone
SpectraBase Compound ID BhQLC4ZcHct
InChI InChI=1S/C11H16O/c1-7-9(12)8-5-6-11(7,4)10(8,2)3/h8H,1,5-6H2,2-4H3/t8-,11-/m1/s1
InChIKey BGDKRGCBUXAWOL-LDYMZIIASA-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 6SSJRLap4Wc
Name (1S,4R)-4,7,7-trimethyl-3-methylene-2-bicyclo[2.2.1]heptanone
CAS Registry Number 26539-82-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c1-7-9(12)8-5-6-11(7,4)10(8,2)3/h8H,1,5-6H2,2-4H3/t8-,11-/m1/s1
InChIKey BGDKRGCBUXAWOL-LDYMZIIASA-N
Molecular Weight 164.248 g/mol
SMILES [C@@]12(C(C(=O)[C@@](C2(C)C)([H])CC1)=C)C
SPLASH splash10-01vk-5900000000-b81bd499b5c76e190915
Source of Spectrum J-45-3521-0
Synonyms (1S,4R)-4,7,7-trimethyl-3-methylene-norbornan-2-one (1S,4R)-4,7,7-trimethyl-3-methylidene-bicyclo[2.2.1]heptan-2-one
Wiley ID 1160824