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Hexanoic anhydride

View entire compound with spectra: 4 NMR, 3 FTIR, 1 Raman, 6 MS (GC), and 2 Near IR

Hexanoic anhydride
SpectraBase Compound ID L2Oz5h0zpGi
InChI InChI=1S/C12H22O3/c1-3-5-7-9-11(13)15-12(14)10-8-6-4-2/h3-10H2,1-2H3
InChIKey PKHMTIRCAFTBDS-UHFFFAOYSA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6zPaAXTVEN1
Name Hexanoic acid, anhydride
Alternate Name(s) Caproic acid anhydride Caproic anhydride Capronic acid anhydride Capronic anhydride Hexanoic acid 1-oxohexyl ester Hexanoic acid caproyl ester Hexanoic anhydride Hexanoyl anhydride Hexanoyl hexanoate n-Caproic anhydride n-Hexanoic acid anhydride n-Hexanoic anhydride AI3-06132 EINECS 218-121-4
CAS Registry Number 2051-49-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-3-5-7-9-11(13)15-12(14)10-8-6-4-2/h3-10H2,1-2H3
InChIKey PKHMTIRCAFTBDS-UHFFFAOYSA-N
Molecular Weight 214.305 g/mol
SMILES CCCCCC(=O)OC(=O)CCCCC
SPLASH splash10-0005-9000000000-517d6c2909003fc3a054
Wiley ID 1469389