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Calacorene<beta->
SpectraBase Compound ID BHEQ18t84RK
InChI InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9-10,13H,4,6,8H2,1-3H3
InChIKey KFYISTOZYAKAPV-UHFFFAOYSA-N
Mol Weight 200.32 g/mol
Molecular Formula C15H20
Exact Mass 200.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CcyEwZdhrpM
Name Calacorene
CAS Registry Number 50277-34-4
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 200.156500644 u
Formula C15H20
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C15H20/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h5,7,9-10,13H,4,6,8H2,1-3H3
InChIKey KFYISTOZYAKAPV-UHFFFAOYSA-N
Molecular Weight 200.325 g/mol
Nominal Mass 200 u
Number of Peaks 110
SMILES C1(CCC(c2c1ccc(c2)C)C(C)C)=C
SPLASH splash10-0a4l-0910000000-009588d3fd1c43331ca0
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA000234