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2-Heptanoylfuran
SpectraBase Compound ID 88CTlgwwg8D
InChI InChI=1S/C11H16O2/c1-2-3-4-5-7-10(12)11-8-6-9-13-11/h6,8-9H,2-5,7H2,1H3
InChIKey BTNRWSUWLFMXEL-UHFFFAOYSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GbhPWGCdplL
Name 2-Heptanoylfuran
Alternate Name(s) 1-(2-Furyl)-1-heptanone 1-(2-furanyl)-1-heptanone 1-(2-furyl)heptan-1-one 1-(furan-2-yl)heptan-1-one 1-Heptanone, 1-(2-furanyl)-
CAS Registry Number 5466-40-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-2-3-4-5-7-10(12)11-8-6-9-13-11/h6,8-9H,2-5,7H2,1H3
InChIKey BTNRWSUWLFMXEL-UHFFFAOYSA-N
Molecular Weight 180.247 g/mol
SMILES c1cc(C(CCCCCC)=O)oc1
SPLASH splash10-03di-0900000000-80e38250e3f5760a14c4
Source of Spectrum SO-0-408-2
Wiley ID 1541410