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tert-Butyl (2E)-5-(acetyloxy)-3-methyl-2-pentenoate
SpectraBase Compound ID 24kZAC4FGCW
InChI InChI=1S/C12H20O4/c1-9(6-7-15-10(2)13)8-11(14)16-12(3,4)5/h8H,6-7H2,1-5H3/b9-8+
InChIKey SAUNBBMSZWUXRI-CMDGGOBGSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8gSbWSgDfYL
Name tert-Butyl (2E)-5-(acetyloxy)-3-methyl-2-pentenoate
CAS Registry Number 77611-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-9(6-7-15-10(2)13)8-11(14)16-12(3,4)5/h8H,6-7H2,1-5H3/b9-8+
InChIKey SAUNBBMSZWUXRI-CMDGGOBGSA-N
Molecular Weight 228.288 g/mol
SMILES CC(=O)OCC\C(C)=C\C(=O)OC(C)(C)C
SPLASH splash10-08fu-9400000000-a5d698251d4629edf9ca
Source of Spectrum W5-0-0-0
Synonyms (E)-5-acetoxy-3-methyl-pent-2-enoic acid tert-butyl ester (E)-5-acetyloxy-3-methyl-2-pentenoic acid tert-butyl ester 2-Pentenoic acid, 5-(acetyloxy)-3-methyl-, 1,1-dimethylethyl ester tert-Butyl (E)-5-acetoxy-3-methyl-pent-2-enoate tert-Butyl (E)-5-acetyloxy-3-methyl-pent-2-enoate
Wiley ID 1229484