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1-[(2S,3S,3aS)-3-(3-Chloro-propyl)-hexahydro-pyrrolo[1,2-b]isoxazol-2-yl]-ethanone
SpectraBase Compound ID Jv9lAlss1Q6
InChI InChI=1S/C11H18ClNO2/c1-8(14)11-9(4-2-6-12)10-5-3-7-13(10)15-11/h9-11H,2-7H2,1H3
InChIKey SVPQQKXLBMVBLF-UHFFFAOYSA-N
Mol Weight 231.72 g/mol
Molecular Formula C11H18ClNO2
Exact Mass 231.102607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IN9VA3NS3KB
Name 1-[(2S,3S,3aS)-3-(3-Chloro-propyl)-hexahydro-pyrrolo[1,2-b]isoxazol-2-yl]-ethanone
Alternate Name(s) (2RS,3RS,3aRS)-3-(3-Chloropropyl)hexahydropyrrolo[1,2-b]isoxazol-2-yl methyl ketone 1-[3-(3-chloropropyl)hexahydropyrrolo[1,2-b]isoxazol-2-yl]ethanone
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Formula C11H18ClNO2
InChI InChI=1S/C11H18ClNO2/c1-8(14)11-9(4-2-6-12)10-5-3-7-13(10)15-11/h9-11H,2-7H2,1H3
InChIKey SVPQQKXLBMVBLF-UHFFFAOYSA-N
Molecular Weight 231.723 g/mol
SMILES C12N(OC(C2CCCCl)C(=O)C)CCC1
SPLASH splash10-05a6-9220000000-7b17c5674377beb64cd4
Source of Spectrum K1-2004-4230-64
Wiley ID 1561666