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(E)-1-(1,3-benzodioxol-5-yl)-1-penten-3-one
SpectraBase Compound ID BP9H0pu5Hhg
InChI InChI=1S/C12H12O3/c1-2-10(13)5-3-9-4-6-11-12(7-9)15-8-14-11/h3-7H,2,8H2,1H3/b5-3+
InChIKey HIHLSOAEMNBULL-HWKANZROSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G0yI1H7DKMT
Name (E)-1-(1,3-benzodioxol-5-yl)-1-penten-3-one
Alternate Name(s) (E)-1-(1,3-benzodioxol-5-yl)pent-1-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-2-10(13)5-3-9-4-6-11-12(7-9)15-8-14-11/h3-7H,2,8H2,1H3/b5-3+
InChIKey HIHLSOAEMNBULL-HWKANZROSA-N
Molecular Weight 204.225 g/mol
SMILES c12c(OCO2)ccc(\C=C\C(=O)CC)c1
SPLASH splash10-004j-2920000000-f5bf5842f371a899921e
Source of Spectrum RB-1982-13786-0
Wiley ID 1201791