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1,3-Butanediol diacetate

View entire compound with spectra: 2 NMR, 5 FTIR, 1 Raman, and 8 MS (GC)

1,3-Butanediol diacetate
SpectraBase Compound ID Aw2SKsvKvgf
InChI InChI=1S/C8H14O4/c1-6(12-8(3)10)4-5-11-7(2)9/h6H,4-5H2,1-3H3
InChIKey MPAGVACEWQNVQO-UHFFFAOYSA-N
Mol Weight 174.2 g/mol
Molecular Formula C8H14O4
Exact Mass 174.089209 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 281P4j1tRd1
Name 1,3-Butanediol diacetate
Source of Sample Aldrich
Catalog Number 201782
CAS Registry Number 1117-31-3
Classification Non-aromatic esters and lactones
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O4
InChI InChI=1S/C8H14O4/c1-6(12-8(3)10)4-5-11-7(2)9/h6H,4-5H2,1-3H3
InChIKey MPAGVACEWQNVQO-UHFFFAOYSA-N
Purity TECH., 90%
Source of Spectrum Sigma-Aldrich Co. LLC.
Technique Neat
Wiley ID SIAL_FTIR_1_3152