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Vertofix coeur
SpectraBase Compound ID 6733TsR4ak0
InChI InChI=1S/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3
InChIKey YBUIAJZFOGJGLJ-UHFFFAOYSA-N
Mol Weight 246.39 g/mol
Molecular Formula C17H26O
Exact Mass 246.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7wMGgx3FnOY
Name Vertofix coeur
Source of Sample SAFC Cat.no. W522805
CAS Registry Number 68039-35-0
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 246.198365456 u
Formula C17H26O
InChI InChI=1S/C17H26O/c1-10-6-7-15-16(4,5)14-9-17(10,15)8-13(11(14)2)12(3)18/h10,14-15H,6-9H2,1-5H3
InChIKey YBUIAJZFOGJGLJ-UHFFFAOYSA-N
Molecular Weight 246.394 g/mol
Number of Peaks 50
RI1 1765
RI2 1441
RI3 1580
RI4 1542
RI5 1754
SMILES C12C(=C(CC3(C(C2(C)C)CCC3C)C1)C(C)=O)C
SPLASH splash10-0006-9710000000-2d7ecec0a582d0c728ec
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Ethanone, 1-(2,3,4,7,8,8a-hexahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl)-
Wiley ID LM_FFNSC3_746