For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1,3-Propanediol, 2,2-dimethyl-, diacetate
SpectraBase Compound ID 8TUXWaj7bES
InChI InChI=1S/C9H16O4/c1-7(10)12-5-9(3,4)6-13-8(2)11/h5-6H2,1-4H3
InChIKey ZFFGZCTVZNNVLP-UHFFFAOYSA-N
Mol Weight 188.22 g/mol
Molecular Formula C9H16O4
Exact Mass 188.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Sovz58VGF9
Name 1,3-Propanediol, 2,2-dimethyl-, diacetate
Alternate Name(s) 3-(Acetyloxy)-2,2-dimethylpropyl acetate (3-acetoxy-2,2-dimethyl-propyl) acetate (3-acetyloxy-2,2-dimethyl-propyl) ethanoate 2,2-Dimethyl-1,3-propanediol diacetate Acetic acid (3-acetoxy-2,2-dimethyl-propyl) ester Acetic acid (3-acetyloxy-2,2-dimethylpropyl) ester Neopentyl glycol diacetate AI3-05750
CAS Registry Number 13431-57-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O4
InChI InChI=1S/C9H16O4/c1-7(10)12-5-9(3,4)6-13-8(2)11/h5-6H2,1-4H3
InChIKey ZFFGZCTVZNNVLP-UHFFFAOYSA-N
Molecular Weight 188.223 g/mol
SMILES CC(COC(C)=O)(COC(C)=O)C
SPLASH splash10-0006-9000000000-ef9eb57b825ee45bdceb
Source of Spectrum AD-0-3049-0
Wiley ID 20188