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SUGIOLE
SpectraBase Compound ID 8EJhiuUn6A4
InChI InChI=1S/C20H28O2/c1-12(2)13-9-14-15(10-16(13)21)20(5)8-6-7-19(3,4)18(20)11-17(14)22/h9-10,12,18,21H,6-8,11H2,1-5H3/t18-,20+/m0/s1
InChIKey IPEHJNRNYPOFII-AZUAARDMSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1b9tTfW9H3C
Name Sugiol
CAS Registry Number 511-05-7
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 300.208930140 u
Formula C20H28O2
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/C20H28O2/c1-12(2)13-9-14-15(10-16(13)21)20(5)8-6-7-19(3,4)18(20)11-17(14)22/h9-10,12,18,21H,6-8,11H2,1-5H3/t18-,20+/m0/s1
InChIKey IPEHJNRNYPOFII-AZUAARDMSA-N
Molecular Weight 300.442 g/mol
Nominal Mass 300 u
Number of Peaks 220
SMILES Oc1cc2[C@]3(C)[C@](C(C)(C)CCC3)(CC(c2cc1C(C)C)=O)[H]
SPLASH splash10-0uy0-2592000000-b5b439be89a463dc6f13
Source ex TAXODIUM DISTICHUM,GREEN CONES, PENTANT EXT.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001290