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2-Pinen-7-one
SpectraBase Compound ID F6mn0GTw8cU
InChI InChI=1S/C10H14O/c1-6-4-5-7-9(11)8(6)10(7,2)3/h4,7-8H,5H2,1-3H3
InChIKey IECBDTGWSQNQID-UHFFFAOYSA-N
Mol Weight 150.22 g/mol
Molecular Formula C10H14O
Exact Mass 150.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Is5bEdPLf3n
Name Chrysanthenone
CAS Registry Number 473-06-3
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 150.104465070 u
Formula C10H14O
InChI InChI=1S/C10H14O/c1-6-4-5-7-9(11)8(6)10(7,2)3/h4,7-8H,5H2,1-3H3
InChIKey IECBDTGWSQNQID-UHFFFAOYSA-N
Molecular Weight 150.221 g/mol
Number of Peaks 50
RI1 1122
RI2 799
SMILES C1(C2CC=C(C1C2(C)C)C)=O
SPLASH splash10-0a4l-9600000000-00d4e0ce0e5e73222450
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 Bicyclo[3.1.1]hept-2-en-6-one, 2,7,7-trimethyl-
Wiley ID LM_FFNSC3_1478