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3-Hexyl butyrate
SpectraBase Compound ID CBgqgKV7Fiu
InChI InChI=1S/C10H20O2/c1-4-7-9(6-3)12-10(11)8-5-2/h9H,4-8H2,1-3H3
InChIKey RCEHZMJZHHUGOL-UHFFFAOYSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2nZTnwnolzT
Name 3-Hexyl butyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-4-7-9(6-3)12-10(11)8-5-2/h9H,4-8H2,1-3H3
InChIKey RCEHZMJZHHUGOL-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 172.268 g/mol
SMILES CCCC(=O)OC(CC)CCC
SPLASH splash10-00dl-9000000000-dd4ff62553a3bfd02a7e
Source of Spectrum SRH-2022-6505-0
Synonyms 1-Ethylbutyl butyrate
Wiley ID 1828335