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3'-(3-CHLOROBUTYL)-SPIRO-[BICYCLO-[4.1.0]-HEPTANE-7,5'-(4'H)-ISOXAZOLE
SpectraBase Compound ID G44xEYnaE9P
InChI InChI=1S/C13H20ClNO/c1-9(14)6-7-10-8-13(16-15-10)11-4-2-3-5-12(11)13/h9,11-12H,2-8H2,1H3
InChIKey ODILJQGHUMISDJ-UHFFFAOYSA-N
Mol Weight 241.76 g/mol
Molecular Formula C13H20ClNO
Exact Mass 241.123342 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKTY1evS47d
Name 3-(3-chloranylbutyl)spiro[4H-1,2-oxazole-5,7'-bicyclo[4.1.0]heptane]
CAS Registry Number 141346-10-3
Comments Less than 3 mono-isotopic peaks
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Formula C13H20ClNO
InChI InChI=1S/C13H20ClNO/c1-9(14)6-7-10-8-13(16-15-10)11-4-2-3-5-12(11)13/h9,11-12H,2-8H2,1H3
InChIKey ODILJQGHUMISDJ-UHFFFAOYSA-N
Molecular Weight 241.762 g/mol
SMILES C12(C3CCCCC23)ON=C(C1)CCC(Cl)C
SPLASH splash10-0006-9000000000-f3633480dfad4564758d
Source of Spectrum J-57-4209-4
Synonyms 3-(3-chlorobutyl)spiro[2-isoxazoline-5,7'-norcarane] 3-(3-chlorobutyl)spiro[4H-1,2-oxazole-5,7'-bicyclo[4.1.0]heptane] 3-(3-chlorobutyl)spiro[4H-isoxazole-5,7'-bicyclo[4.1.0]heptane] 3-(3-chlorobutyl)spiro[4H-isoxazole-5,7'-norcarane]
Wiley ID 1244077