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Khusinol acetate
SpectraBase Compound ID 2sOHst33ZNU
InChI InChI=1S/C17H26O2/c1-10(2)14-7-6-12(4)17-15(14)8-11(3)9-16(17)19-13(5)18/h8,10,14-17H,4,6-7,9H2,1-3,5H3/t14-,15-,16-,17-/m1/s1
InChIKey FRBOFOXWQNXDHB-QBPKDAKJSA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DaYOfmkTDOY
Name Khusinol acetate
CAS Registry Number 78405-34-2
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 262.193280075 u
Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-10(2)14-7-6-12(4)17-15(14)8-11(3)9-16(17)19-13(5)18/h8,10,14-17H,4,6-7,9H2,1-3,5H3/t14-,15-,16-,17-/m1/s1
InChIKey FRBOFOXWQNXDHB-QBPKDAKJSA-N
Molecular Weight 262.393 g/mol
Number of Peaks 50
RI1 1825
SMILES C1C[C@](C(C)C)([C@@]2([C@@](C1=C)([C@@](CC(=C2)C)(OC(=O)C)[H])[H])[H])[H]
SPLASH splash10-052g-6900000000-42951826e499dcd2830f
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 1-naphthalenol, 1,2,4a,5,6,7,8,8a-octahydro-3-methyl-8-methylene-5-(1-methylethyl)-acetate,(1R-(1alpha,4abeta,5beta,8aaplha))-
Wiley ID LM_FFNSC3_2556