SpectraBase Spectrum ID |
H5TvO3ZGNaW |
Name |
methyl (2R)-1-[(3-bromophenyl)methyl]-4-oxo-azetidine-2-carboxylate |
Appearance |
Oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H12BrNO3 |
InChI |
InChI=1S/C12H12BrNO3/c1-17-12(16)10-6-11(15)14(10)7-8-3-2-4-9(13)5-8/h2-5,10H,6-7H2,1H3/t10-/m1/s1 |
InChIKey |
NRBYXKOBJNMCIP-SNVBAGLBSA-N |
Ionization Type |
EI |
Optical Rotation |
[a]D25 = +32 (c = 0.5, CHCl3) |
Reported Formula |
C12H12BrNO3 |
SMILES |
C1C(N([C@]1(C(=O)OC)[H])Cc1cc(ccc1)Br)=O |
SPLASH |
splash10-01b9-0920000000-3513e627e6171b08df7c |
Sample Comments |
97% ee |
Source of Spectrum |
CN102126999B |
Wiley ID |
1846491 |