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3-Pentenoic acid, 2,4-dimethyl-, 1-methylethyl ester, (S)-
SpectraBase Compound ID 7WLNp69pylk
InChI InChI=1S/C10H18O2/c1-7(2)6-9(5)10(11)12-8(3)4/h6,8-9H,1-5H3
InChIKey KLZJQXARTFIXBE-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IHiieCej0vZ
Name 3-Pentenoic acid, 2,4-dimethyl-, 1-methylethyl ester, (S)-
Alternate Name(s) 1-Methylethyl 2,4-diemthyl-3-pentenoate isopropyl 2,4-dimethyl-3-pentenoate
CAS Registry Number 108584-76-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-7(2)6-9(5)10(11)12-8(3)4/h6,8-9H,1-5H3
InChIKey KLZJQXARTFIXBE-UHFFFAOYSA-N
Molecular Weight 170.252 g/mol
SMILES C(C(C=C(C)C)C)(OC(C)C)=O
SPLASH splash10-053r-9100000000-53975b1542ce3bafe7fe
Source of Spectrum F-45-6189-23
Wiley ID 1167155