| SpectraBase Spectrum ID |
EOfT2DUWItU |
| Name |
(3S,4S)-4-(1-Bromo-1-methyl-ethyl)-1-tert-butyl-3-methoxy-azetidin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.067741886 u |
| Formula |
C11H20BrNO2 |
| InChI |
InChI=1S/C11H20BrNO2/c1-10(2,3)13-8(11(4,5)12)7(15-6)9(13)14/h7-8H,1-6H3/t7-,8-/m0/s1 |
| InChIKey |
IXSDJNLEFOVTQY-YUMQZZPRSA-N |
| SMILES |
C1(N([C@@]([C@@]1(OC)[H])(C(Br)(C)C)[H])C(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936716 |
