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n-Butyl butyrate

View entire compound with spectra: 6 NMR, 12 FTIR, 1 Raman, 30 MS (GC), and 2 Near IR

n-Butyl butyrate
SpectraBase Compound ID Es41Fyd0WU5
InChI InChI=1S/C8H16O2/c1-3-5-7-10-8(9)6-4-2/h3-7H2,1-2H3
InChIKey XUPYJHCZDLZNFP-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8TsU6oJaRSm
Name BUTANOIC ACID, BUTYL ESTER
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 144.115029753 u
Formula C8H16O2
InChI InChI=1S/C8H16O2/c1-3-5-7-10-8(9)6-4-2/h3-7H2,1-2H3
InChIKey XUPYJHCZDLZNFP-UHFFFAOYSA-N
Molecular Weight 144.214 g/mol
Nominal Mass 144 u
Number of Peaks 40
SMILES CCCC(OCCCC)=O
SPLASH splash10-05bo-9000000000-454a443cc8bbc0ba9e7b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany
Wiley ID MVX000366