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Nonane-1,3-diol acetate
SpectraBase Compound ID 6hZqzO6EogN
InChI InChI=1S/C11H22O3/c1-3-4-5-6-7-11(13)8-9-14-10(2)12/h11,13H,3-9H2,1-2H3
InChIKey RTYFAKSWXDNPPU-UHFFFAOYSA-N
Mol Weight 202.29 g/mol
Molecular Formula C11H22O3
Exact Mass 202.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkObgdGbAhh
Name Nonane-1,3-diol acetate
Source of Sample SAFC Cat.no. W278300
CAS Registry Number 1322-17-4
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 202.156894565 u
Formula C11H22O3
InChI InChI=1S/C11H22O3/c1-3-4-5-6-7-11(13)8-9-14-10(2)12/h11,13H,3-9H2,1-2H3
InChIKey RTYFAKSWXDNPPU-UHFFFAOYSA-N
Molecular Weight 202.294 g/mol
Number of Peaks 50
RI1 1473
RI2 1151
RI3 1279
RI4 1239
SMILES OC(CCOC(C)=O)CCCCCC
SPLASH splash10-00l6-9000000000-79295c65ae79990d7d29
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 1,3-Nonanediol, monoacetate
Wiley ID LM_FFNSC3_945