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(3S,5aR,8aS,8bR)-2,3,5a,6,7,8,8a,8b-Octahydro-3-isopropyl-8b-methyl-5H-cyclopenta[3,4]pyrrolo[2,1-b]oxazol-5-one
SpectraBase Compound ID IohrwzV9A81
InChI InChI=1S/C13H21NO2/c1-8(2)11-7-16-13(3)10-6-4-5-9(10)12(15)14(11)13/h8-11H,4-7H2,1-3H3/t9-,10+,11-,13-/m1/s1
InChIKey CFAOHMGJKUDGKV-LSCVPOLPSA-N
Mol Weight 223.32 g/mol
Molecular Formula C13H21NO2
Exact Mass 223.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AYMhxp5RSm7
Name (3S,5aR,8aS,8bR)-2,3,5a,6,7,8,8a,8b-Octahydro-3-isopropyl-8b-methyl-5H-cyclopenta[3,4]pyrrolo[2,1-b]oxazol-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21NO2
InChI InChI=1S/C13H21NO2/c1-8(2)11-7-16-13(3)10-6-4-5-9(10)12(15)14(11)13/h8-11H,4-7H2,1-3H3/t9-,10+,11-,13-/m1/s1
InChIKey CFAOHMGJKUDGKV-LSCVPOLPSA-N
Molecular Weight 223.316 g/mol
SMILES [C@@]12(N([C@](CO2)(C(C)C)[H])C([C@@]2(CCC[C@]12[H])[H])=O)C
SPLASH splash10-052r-3910000000-db1976454b19e9bfa33e
Source of Spectrum H-79-1043-61
Synonyms (3S,5aR,8aS,8bR)-3-isopropyl-8b-methyloctahydro-5H-cyclopenta[3,4]pyrrolo[2,1-b][1,3]oxazol-5-one (3S,5aR,8aS,8bR)-8b-methyl-3-propan-2-yl-3,5a,6,7,8,8a-hexahydro-2H-cyclopenta[1,2]pyrrolo[4,5-b]oxazol-5-one (3S,5aR,8aS,8bR)-8b-methyl-3-propan-2-yl-3,5a,6,7,8,8a-hexahydro-2H-cyclopenta[1,2]pyrrolo[4,5-b][1,3]oxazol-5-one
Wiley ID 1224094