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4,5-Dihydrocaryophyllen-5-one
SpectraBase Compound ID Kib3SbcxqcR
InChI InChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h11-13H,1,5-9H2,2-4H3/t11?,12-,13-/m1/s1
InChIKey GWBJPNAWYMBRLQ-VFRRUGBOSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KbIX0OBluLD
Name 4,5-Dihydrocaryophyllen-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-10-6-8-14(16)11(2)5-7-13-12(10)9-15(13,3)4/h11-13H,1,5-9H2,2-4H3/t11?,12-,13-/m1/s1
InChIKey GWBJPNAWYMBRLQ-VFRRUGBOSA-N
Molecular Weight 220.356 g/mol
SMILES [C@]12([C@](CCC(C)C(CCC2=C)=O)([H])C(C1)(C)C)[H]
SPLASH splash10-05pt-9400000000-db2b7b4f653b92217c7a
Source of Spectrum AJ-66-220-0
Synonyms (1S,9R)-6,10,10-trimethyl-2-methylenebicyclo[7.2.0]undecan-5-one
Wiley ID 771962