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3-tert-Butyl-7a-(1-hydroxy-1-methylethyl)-1-oxotetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-6-yl 3-hydroxy-3-methylbutanoate
SpectraBase Compound ID GYvVWlaEPho
InChI InChI=1S/C18H31NO6/c1-15(2,3)13-19-10-11(24-12(20)9-16(4,5)22)8-18(19,14(21)25-13)17(6,7)23/h11,13,22-23H,8-10H2,1-7H3
InChIKey VBEJQAMJWPUOTR-UHFFFAOYSA-N
Mol Weight 357.45 g/mol
Molecular Formula C18H31NO6
Exact Mass 357.215138 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1iQL1xsGCs5
Name 3-tert-Butyl-7a-(1-hydroxy-1-methylethyl)-1-oxotetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-6-yl 3-hydroxy-3-methylbutanoate
CAS Registry Number 97652-11-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H31NO6
InChI InChI=1S/C18H31NO6/c1-15(2,3)13-19-10-11(24-12(20)9-16(4,5)22)8-18(19,14(21)25-13)17(6,7)23/h11,13,22-23H,8-10H2,1-7H3
InChIKey VBEJQAMJWPUOTR-UHFFFAOYSA-N
Molecular Weight 357.447 g/mol
SMILES OC(C12CC(OC(CC(C)(C)O)=O)CN1C(OC2=O)C(C)(C)C)(C)C
SPLASH splash10-0536-9220000000-46899feacd95ac9633c9
Source of Spectrum H-68-160-9
Synonyms Butanoic acid, 3-hydroxy-3-methyl-, 3-(1,1-dimethylethyl)tetrahydro-7a-(1-hydroxy-1-methylethyl)-1-oxo-1H,3H-pyrrolo[1,2-c]oxazol-6-yl ester, [3R-(3.alpha.,6.alpha., 7a.alpha)]- 3-Hydroxy-3-methylbutanoic acid [3-tert-butyl-7a-(2-hydroxypropan-2-yl)-1-oxo-3,5,6,7-tetrahydropyrrolo[1,2-c]oxazol-6-yl] ester [3-tert-butyl-7a-(2-hydroxypropan-2-yl)-1-oxo-3,5,6,7-tetrahydropyrrolo[1,2-c][1,3]oxazol-6-yl] 3-hydroxy-3-methylbutanoate [3-tert-butyl-7a-(1-hydroxy-1-methyl-ethyl)-1-oxo-3,5,6,7-tetrahydropyrrolo[1,2-c]oxazol-6-yl] 3-hydroxy-3-methyl-butanoate [3-tert-butyl-1-oxidanylidene-7a-(2-oxidanylpropan-2-yl)-3,5,6,7-tetrahydropyrrolo[1,2-c][1,3]oxazol-6-yl] 3-methyl-3-oxidanyl-butanoate
Wiley ID 1346405