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4'-Chloro-2'(E)-pentenyl 2-Propynoate
SpectraBase Compound ID 7oHlBE07dKe
InChI InChI=1S/C8H9ClO2/c1-4-8(10)11-7(3)5-6(2)9/h1,5-6H,2-3H3/b7-5+
InChIKey CRPJIGMITMCTIR-FNORWQNLSA-N
Mol Weight 172.61 g/mol
Molecular Formula C8H9ClO2
Exact Mass 172.029107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EqIIGVhO9Pl
Name 4'-Chloro-2'(E)-pentenyl 2-Propynoate
Alternate Name(s) (1E)-3-chloro-1-methyl-1-butenyl propiolate
CAS Registry Number 134078-82-3
Comments Less than 3 mono-isotopic peaks
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Formula C8H9ClO2
InChI InChI=1S/C8H9ClO2/c1-4-8(10)11-7(3)5-6(2)9/h1,5-6H,2-3H3/b7-5+
InChIKey CRPJIGMITMCTIR-FNORWQNLSA-N
Molecular Weight 172.611 g/mol
SMILES C(C(O\C(=C\C(Cl)C)C)=O)#C
SPLASH splash10-0udi-9000000000-d98dd319d89c62468357
Source of Spectrum J-56-5124-1
Wiley ID 1168372