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5-(Hept-2-yn-1-ylidene)-3-methyltetrahydrofuran-2-one
SpectraBase Compound ID 1BDlRvqTWG2
InChI InChI=1S/C12H16O2/c1-3-4-5-6-7-8-11-9-10(2)12(13)14-11/h8,10H,3-5,9H2,1-2H3/b11-8-
InChIKey NNIYYKLSHKTEMH-FLIBITNWSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JsjFciwEPi7
Name 5-(Hept-2-yn-1-ylidene)-3-methyltetrahydrofuran-2-one
Alternate Name(s) (5Z)-5-(2-heptynylidene)-3-methyldihydro-2(3H)-furanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-3-4-5-6-7-8-11-9-10(2)12(13)14-11/h8,10H,3-5,9H2,1-2H3/b11-8-
InChIKey NNIYYKLSHKTEMH-FLIBITNWSA-N
Molecular Weight 192.258 g/mol
SMILES C1(O\C(=C/C#CCCCC)CC1C)=O
SPLASH splash10-0fic-9600000000-5340b001ba397210f742
Source of Spectrum AT-33-2814-1
Wiley ID 836268