For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

tert-Butyl (2S,3R)-tert-Butyl 2-(3-(3-acetyl-3-methyloxiran-2-yl)propyl)-1H-pyrrole-1-carboxylate(3-(3-acetyl-3-methyloxiran-2-yl)propyl)-1H-pyrrole-1-carboxylat

View entire compound with spectra: 1 MS (GC)

tert-Butyl (2S,3R)-tert-Butyl 2-(3-(3-acetyl-3-methyloxiran-2-yl)propyl)-1H-pyrrole-1-carboxylate(3-(3-acetyl-3-methyloxiran-2-yl)propyl)-1H-pyrrole-1-carboxylat
SpectraBase Compound ID 6q37VMHNIVs
InChI InChI=1S/C17H25NO4/c1-12(19)17(5)14(21-17)10-6-8-13-9-7-11-18(13)15(20)22-16(2,3)4/h7,9,11,14H,6,8,10H2,1-5H3/t14-,17-/m1/s1
InChIKey KTJPUQKNDCIDCW-RHSMWYFYSA-N
Mol Weight 307.39 g/mol
Molecular Formula C17H25NO4
Exact Mass 307.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID HZ2zvQKIPBM
Name tert-Butyl (2S,3R)-tert-Butyl 2-(3-(3-acetyl-3-methyloxiran-2-yl)propyl)-1H-pyrrole-1-carboxylate(3-(3-acetyl-3-methyloxiran-2-yl)propyl)-1H-pyrrole-1-carboxylat
Appearance Pale yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25NO4
InChI InChI=1S/C17H25NO4/c1-12(19)17(5)14(21-17)10-6-8-13-9-7-11-18(13)15(20)22-16(2,3)4/h7,9,11,14H,6,8,10H2,1-5H3/t14-,17-/m1/s1
InChIKey KTJPUQKNDCIDCW-RHSMWYFYSA-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 114
Reported Formula C17H25NO4
SMILES C([C@@]1([C@](O1)(CCCC1=CC=CN1C(OC(C)(C)C)=O)[H])C)(C)=O
SPLASH splash10-008c-9510000000-491af5584935f3f8074e
Source of Spectrum ACI-57-SM33-2h.5 (DOI: 10.1002/anie.201711439)
Thin-Layer Chromatography 0.28 (EtOAc/hexane, 5%)
Wiley ID 1890689