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Pipitzol<o-methyl,beta->
SpectraBase Compound ID CVDXmGF8u9f
InChI InChI=1S/C16H22O3/c1-8-6-7-10-15(3,4)11-9(2)12(19-5)14(18)16(8,10)13(11)17/h8,10-11H,6-7H2,1-5H3
InChIKey NFANDAUYLLKKGW-UHFFFAOYSA-N
Mol Weight 262.35 g/mol
Molecular Formula C16H22O3
Exact Mass 262.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DRhEeFaoqtx
Name Pipitzol
CAS Registry Number 106790-99-2
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 262.156894565 u
Formula C16H22O3
InChI InChI=1S/C16H22O3/c1-8-6-7-10-15(3,4)11-9(2)12(19-5)14(18)16(8,10)13(11)17/h8,10-11H,6-7H2,1-5H3
InChIKey NFANDAUYLLKKGW-UHFFFAOYSA-N
Molecular Weight 262.349 g/mol
Number of Peaks 50
RI1 1854
SMILES C=1(C(C23C(C(C(C1C)C3=O)(C)C)CCC2C)=O)OC
SPLASH splash10-06si-3690000000-1798559255e7c79edddb
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 4H-3a,7-Methanoazulene-4,9-dione, 1,2,3,7,8,8a-hexahydro-5-methoxy-3,6,8,8-tetramethyl-
Wiley ID LM_FFNSC3_2110