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1,7-Heptanediol diacetate
SpectraBase Compound ID 4pBhcD3yFYv
InChI InChI=1S/C11H20O4/c1-10(12)14-8-6-4-3-5-7-9-15-11(2)13/h3-9H2,1-2H3
InChIKey MABSJAOVZMJMDT-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C11H20O4
Exact Mass 216.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvT1b2XtpcT
Name 7-(Acetyloxy)heptyl acetate
Alternate Name(s) Heptamethylene diacetate Acetic acid 7-acetyloxyheptyl ester 7-Acetyloxyheptyl acetate 7-Acetoxyheptyl acetate 7-Acetyloxyheptyl ethanoate
CAS Registry Number 52819-34-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20O4
InChI InChI=1S/C11H20O4/c1-10(12)14-8-6-4-3-5-7-9-15-11(2)13/h3-9H2,1-2H3
InChIKey MABSJAOVZMJMDT-UHFFFAOYSA-N
Molecular Weight 216.277 g/mol
SMILES CC(OCCCCCCCOC(C)=O)=O
SPLASH splash10-014l-9000000000-05effa0b565390108489
Source of Spectrum NP-5-381-0
Wiley ID 1104536