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trans-4-(2-Furyl)-3-buten-2-one
SpectraBase Compound ID 6wcYbSGLRfD
InChI InChI=1S/C8H8O2/c1-7(9)4-5-8-3-2-6-10-8/h2-6H,1H3/b5-4+
InChIKey GBKGJMYPQZODMI-SNAWJCMRSA-N
Mol Weight 136.15 g/mol
Molecular Formula C8H8O2
Exact Mass 136.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1L6X8DsrFg
Name Furfuryl acetone
CAS Registry Number 623-15-4
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 136.052429496 u
Formula C8H8O2
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 μm film thickness)
GC Oven Program 60 °C to 246 °C at 3 °C/min.
InChI InChI=1S/C8H8O2/c1-7(9)4-5-8-3-2-6-10-8/h2-6H,1H3/b5-4+
InChIKey GBKGJMYPQZODMI-SNAWJCMRSA-N
Molecular Weight 136.150 g/mol
Nominal Mass 136 u
Number of Peaks 59
SMILES c1(\C=C\C(C)=O)ccco1
SPLASH splash10-00rf-9500000000-68b0a8ad6d1a25bd1627
Source ex BEDOUKIAN RES.
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID RA001638