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Laurenan-2-one
SpectraBase Compound ID 87VsLkmJ6wc
InChI InChI=1S/C20H32O/c1-13-7-6-9-18(4)10-8-15-17(2,3)12-19(5)11-14(21)16(13)20(15,18)19/h13,15-16H,6-12H2,1-5H3/t13-,15-,16?,18+,19-,20?/m1/s1
InChIKey CUSFSWBSNJUWHI-MICIBEHWSA-N
Mol Weight 288.5 g/mol
Molecular Formula C20H32O
Exact Mass 288.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1312vMEYZk
Name Laurenan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O
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/C20H32O/c1-13-7-6-9-18(4)10-8-15-17(2,3)12-19(5)11-14(21)16(13)20(15,18)19/h13,15-16H,6-12H2,1-5H3/t13-,15-,16?,18+,19-,20?/m1/s1
InChIKey CUSFSWBSNJUWHI-MICIBEHWSA-N
Molecular Weight 288.475 g/mol
SMILES [C@]12(C34[C@@](C(C2)(C)C)(CC[C@@]4(CCC[C@](C3C(C1)=O)(C)[H])C)[H])C
SPLASH splash10-0nmu-6950000000-ba55c4356dda7930347b
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886595