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Pentanoic acid, 3,4,4-trimethyl-, ethyl ester
SpectraBase Compound ID 5tpMeWK7Idv
InChI InChI=1S/C10H20O2/c1-6-12-9(11)7-8(2)10(3,4)5/h8H,6-7H2,1-5H3
InChIKey OWFILQFKUKAHSY-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 BCCAsdrzoDX
Name Pentanoic acid, 3,4,4-trimethyl-, ethyl ester
Alternate Name(s) Ethyl 3,4,4-trimethylpentanoate 3,4,4-trimethylpentanoic acid ethyl ester 3,4,4-trimethylvaleric acid ethyl ester
CAS Registry Number 106325-27-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-6-12-9(11)7-8(2)10(3,4)5/h8H,6-7H2,1-5H3
InChIKey OWFILQFKUKAHSY-UHFFFAOYSA-N
Molecular Weight 172.268 g/mol
SMILES CC(C)(C(C)CC(=O)OCC)C
SPLASH splash10-05ox-9200000000-356b66bff8c41491f8bb
Wiley ID 1488813