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(3S,6S,7aR)-3-isopropyl-6,7a-dimethyl-5-oxo-6-(2-pyridylmethyl)-2,3,5,6,7,7a-hexahydropyrrolo[2,1-b]oxazole
SpectraBase Compound ID 7cN0wq8icy9
InChI InChI=1S/C17H24N2O2/c1-12(2)14-10-21-17(4)11-16(3,15(20)19(14)17)9-13-7-5-6-8-18-13/h5-8,12,14H,9-11H2,1-4H3/t14-,16+,17-/m1/s1
InChIKey FMMCITCYIUXEFV-HYVNUMGLSA-N
Mol Weight 288.39 g/mol
Molecular Formula C17H24N2O2
Exact Mass 288.183778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4v3YK6ij3bW
Name (3S,6S,7aR)-3-isopropyl-6,7a-dimethyl-5-oxo-6-(2-pyridylmethyl)-2,3,5,6,7,7a-hexahydropyrrolo[2,1-b]oxazole
CAS Registry Number 126062-90-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24N2O2
InChI InChI=1S/C17H24N2O2/c1-12(2)14-10-21-17(4)11-16(3,15(20)19(14)17)9-13-7-5-6-8-18-13/h5-8,12,14H,9-11H2,1-4H3/t14-,16+,17-/m1/s1
InChIKey FMMCITCYIUXEFV-HYVNUMGLSA-N
Molecular Weight 288.391 g/mol
SMILES [C@@]12(N([C@](CO2)(C(C)C)[H])C([C@](C1)(Cc1ncccc1)C)=O)C
SPLASH splash10-0007-9610000000-c8a1c216bba1f987bb21
Source of Spectrum J-55-3141-5
Synonyms (3S,6S,7aR)-3-isopropyl-6,7a-dimethyl-6-(2-pyridinylmethyl)tetrahydropyrrolo[2,1-b][1,3]oxazol-5(6H)-one
Wiley ID 1291887