2-(5-Acetyl-2,3-dihydro-1-benzofuran-2-yl)-2-propen-1-yl 3-methylbutanoate

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Systematic / IUPAC Name: 2-(5-Acetyl-2,3-dihydro-1-benzofuran-2-yl)prop-2-enyl 3-methylbutanoate

ID: Reference7973

Other Names: Butanoic acid, 3-methyl-, 2-(5-acetyl-2,3-dihydro-2-benzofuranyl)-2-propen-1-yl ester

Formula: C18H22O4

Spectral Data

2-(5-Acetyl-2,3-dihydro-1-benzofuran-2-yl)-2-propen-1-yl 3-methylbutanoate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 162
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 5/17/2018 7:17:18 AM
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Identificators

InChI InChI=1S/C18H22O4/c1-11(2)7-18(20)21-10-12(3)17-9-15-8-14(13(4)19)5-6-16(15)22-17/h5-6,8,11,17H,3,7,9-10H2,1-2,4H3
InChI Key QKDHVEHKHGYWMD-UHFFFAOYSA-N
Canonical SMILES CC(C)CC(=O)OCC(=C)C1CC2=C(O1)C=CC(=C2)C(=O)C
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Other Names Butanoic acid, 3-methyl-, 2-(5-acetyl-2,3-dihydro-2-benzofuranyl)-2-propen-1-yl ester

In Other Databases

ChemSpider 29814170
PubChem 56776230