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(2R,3R)-3-(bromomethyl)-2-oxiranecarboxamide

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

(2R,3R)-3-(bromomethyl)-2-oxiranecarboxamide
SpectraBase Compound ID 5s7hlgXipKB
InChI InChI=1S/C4H6BrNO2/c5-1-2-3(8-2)4(6)7/h2-3H,1H2,(H2,6,7)/t2-,3+/m0/s1
InChIKey LPGHTPBJCLMTPF-STHAYSLISA-N
Mol Weight 180.0 g/mol
Molecular Formula C4H6BrNO2
Exact Mass 178.958191 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9b6IZmtaitc
Name (2R,3R)-3-(Bromomethyl)-2-oxiranecarboxamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.958191435 u
Formula C4H6BrNO2
InChI InChI=1S/C4H6BrNO2/c5-1-2-3(8-2)4(6)7/h2-3H,1H2,(H2,6,7)/t2-,3+/m0/s1
InChIKey LPGHTPBJCLMTPF-STHAYSLISA-N
Molecular Weight 180.001 g/mol
SMILES [C@@]1(O[C@]1(CBr)[H])(C(=O)N)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.92363