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1,5-Diacetoxypentane

View entire compound with spectra: 2 NMR, 2 FTIR, and 2 MS (GC)

1,5-Diacetoxypentane
SpectraBase Compound ID J3INfxqwatw
InChI InChI=1S/C9H16O4/c1-8(10)12-6-4-3-5-7-13-9(2)11/h3-7H2,1-2H3
InChIKey PIJBVCVBCQOWMM-UHFFFAOYSA-N
Mol Weight 188.22 g/mol
Molecular Formula C9H16O4
Exact Mass 188.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4WniWLjRbs
Name 1,5-Diacetoxypentane
Alternate Name(s) 1,5-Pentanediol, diacetate 5-Acetoxypentyl acetate 5-Acetyloxypentyl acetate 5-Acetyloxypentyl ethanoate Acetic acid 5-acetoxypentyl ester Acetic acid 5-acetyloxypentyl ester Pentamethylene acetate
CAS Registry Number 6963-44-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O4
InChI InChI=1S/C9H16O4/c1-8(10)12-6-4-3-5-7-13-9(2)11/h3-7H2,1-2H3
InChIKey PIJBVCVBCQOWMM-UHFFFAOYSA-N
Molecular Weight 188.223 g/mol
SMILES CC(=O)OCCCCCOC(=O)C
SPLASH splash10-00kf-9000000000-6622257a43ad89692b3f
Wiley ID 1491302