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1-Methylbutyl pentanoate
SpectraBase Compound ID 9D32YR1vBXV
InChI InChI=1S/C10H20O2/c1-4-6-8-10(11)12-9(3)7-5-2/h9H,4-8H2,1-3H3
InChIKey DPWXZALITOQKDT-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 BzvAcqCQDIX
Name 1-Methylbutyl pentanoate
Alternate Name(s) Pentan-2-yl pentanoate Pentanoic acid, 2-pentyl ester Pentanoic acid pentan-2-yl ester valeric acid 1-methylbutyl ester
CAS Registry Number 89155-38-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-4-6-8-10(11)12-9(3)7-5-2/h9H,4-8H2,1-3H3
InChIKey DPWXZALITOQKDT-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES CCCCC(=O)OC(CCC)C
SPLASH splash10-000i-9100000000-63a996656183716f85e0
Source of Spectrum NP-2-5864-0
Wiley ID 1101354