4-(4-Methyl-2,6,7-trioxabocyclo[2.2.2]octyl)-cyclopenteno[d].delta.(2)-isoxazoline

SpectraBase Compound ID	kB9vkG9l9u
InChI	InChI=1S/C12H17NO4/c1-11-5-14-12(15-6-11,16-7-11)10-8-3-2-4-9(8)17-13-10/h8-9H,2-7H2,1H3/t8-,9+,11-,12?/m1/s1
InChIKey	VCORZUUGTOOTOF-RVJXMIQCSA-N Google Search
Mol Weight	239.27 g/mol
Molecular Formula	C12H17NO4
Exact Mass	239.115758 g/mol

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SpectraBase Spectrum ID	3cMKXdcemsG
Name	4-(4-Methyl-2,6,7-trioxabocyclo[2.2.2]octyl)-cyclopenteno[d].delta.(2)-isoxazoline
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C12H17NO4
InChI	InChI=1S/C12H17NO4/c1-11-5-14-12(15-6-11,16-7-11)10-8-3-2-4-9(8)17-13-10/h8-9H,2-7H2,1H3/t8-,9+,11-,12?/m1/s1
InChIKey	VCORZUUGTOOTOF-RVJXMIQCSA-N
Molecular Weight	239.271 g/mol
SMILES	C1(C23OCC(CO3)(C)CO2)=NO[C@@]2([C@]1(CCC2)[H])[H]
SPLASH	splash10-000i-3910000000-20988c3755764ec2c07a
Source of Spectrum	AT-40-7958-0
Synonyms	(3aS,6aS)-3-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d]isoxazole (3aS,6aS)-3-(1-methyl-3,5,8-trioxabicyclo[2.2.2]octan-4-yl)-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,2]oxazole
Wiley ID	854712