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(-)-ACORENONE
SpectraBase Compound ID 188LohkF7nv
InChI InChI=1S/C15H24O/c1-10(2)13-6-5-12(4)15(13)8-7-11(3)14(16)9-15/h7,10,12-13H,5-6,8-9H2,1-4H3/t12-,13-,15+/m0/s1
InChIKey HBTHUBMUAHAWBC-KCQAQPDRSA-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 Am4Kwfysp8z
Name Acorenone B
CAS Registry Number 21653-33-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C15H24O/c1-10(2)13-6-5-12(4)15(13)8-7-11(3)14(16)9-15/h7,10,12-13H,5-6,8-9H2,1-4H3/t12-,13-,15+/m0/s1
InChIKey HBTHUBMUAHAWBC-KCQAQPDRSA-N
Molecular Weight 220.356 g/mol
SMILES [C@]1(CC[C@]([C@]11CC(C(=CC1)C)=O)(C(C)C)[H])(C)[H]
SPLASH splash10-052o-9600000000-61fe462b8f051589e6a0
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1885793