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2H-Hexahydro-2-(3-chloropropyl)-2-cyano-6-phenyloxazolo[3,2-a]pyridine
SpectraBase Compound ID 84rV00UZ2No
InChI InChI=1S/C17H21ClN2O/c18-10-4-9-17(12-19)13-20-11-15(7-8-16(20)21-17)14-5-2-1-3-6-14/h1-3,5-6,15-16H,4,7-11,13H2
InChIKey PSJLNJRNBPELGB-UHFFFAOYSA-N
Mol Weight 304.82 g/mol
Molecular Formula C17H21ClN2O
Exact Mass 304.134241 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7NN0ko42EGx
Name 2H-Hexahydro-2-(3-chloropropyl)-2-cyano-6-phenyloxazolo[3,2-a]pyridine
Comments Less than 3 mono-isotopic peaks
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Formula C17H21ClN2O
InChI InChI=1S/C17H21ClN2O/c18-10-4-9-17(12-19)13-20-11-15(7-8-16(20)21-17)14-5-2-1-3-6-14/h1-3,5-6,15-16H,4,7-11,13H2
InChIKey PSJLNJRNBPELGB-UHFFFAOYSA-N
Molecular Weight 304.821 g/mol
SMILES C12N(CC(O2)(C#N)CCCCl)CC(CC1)c1ccccc1
SPLASH splash10-004i-0093000000-f394fef17e2d215a315f
Source of Spectrum J-58-6455-2
Synonyms 2-(3-chloropropyl)-6-phenylhexahydro-5H-[1,3]oxazolo[3,2-a]pyridine-2-carbonitrile
Wiley ID 1306476