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tert-Butyl 2-(3-((2R*,3S*)-3-acetyloxiran-2-yl)propyl)-3-methyl-1H-pyrrole-1-carboxylate
SpectraBase Compound ID 5J1YZduH9Qw
InChI InChI=1S/C17H25NO4/c1-11-9-10-18(16(20)22-17(3,4)5)13(11)7-6-8-14-15(21-14)12(2)19/h9-10,14-15H,6-8H2,1-5H3/t14-,15-/m1/s1
InChIKey BUGCZSUGKIESNB-HUUCEWRRSA-N
Mol Weight 307.39 g/mol
Molecular Formula C17H25NO4
Exact Mass 307.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fr9tqqs1Mqo
Name tert-Butyl 2-(3-((2R*,3S*)-3-acetyloxiran-2-yl)propyl)-3-methyl-1H-pyrrole-1-carboxylate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO4
InChI InChI=1S/C17H25NO4/c1-11-9-10-18(16(20)22-17(3,4)5)13(11)7-6-8-14-15(21-14)12(2)19/h9-10,14-15H,6-8H2,1-5H3/t14-,15-/m1/s1
InChIKey BUGCZSUGKIESNB-HUUCEWRRSA-N
Instrument Name Finnigan MAT 95 or API QSTAR PULSAR iLC/MS/TOF
Ionization Type EI
Literature Reference DOI 10.1002/anie.201711439
Molecular Weight 307.390 g/mol
Quality 98
Reported Formula C17H25NO4
SMILES C([C@@]1([C@](O1)(CCCC1=C(C=CN1C(OC(C)(C)C)=O)C)[H])[H])(C)=O
SPLASH splash10-0006-9320000000-6e7d6e2ec3998a761c3b
Source of Spectrum ACI-57-SM50-2k.7 (DOI: 10.1002/anie.201711439)
Thin-Layer Chromatography 0.39 (EtOAc/hexane, 10%)
Wiley ID 1890703