SpectraBase Spectrum ID |
BOff4LpuaQm |
Name |
N-Benzoyl-L-threonyl-L-leucine methyl ester |
Appearance |
Crystalline solid |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
350.184171940 u |
Formula |
C18H26N2O5 |
InChI |
InChI=1S/C18H26N2O5/c1-11(2)10-14(18(24)25-4)19-17(23)15(12(3)21)20-16(22)13-8-6-5-7-9-13/h5-9,11-12,14-15,21H,10H2,1-4H3,(H,19,23)(H,20,22)/t12-,14+,15+/m1/s1 |
InChIKey |
UHTVNJUUVZSPGR-SNPRPXQTSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/chem.201703758 |
Molecular Weight |
350.415 g/mol |
Optical Rotation |
[a]D = -68 (c = 0.17, CHCl3) |
Quality |
16 |
Reported Formula |
C18H26N2O5 |
SMILES |
N([C@](C(N[C@](C(=O)OC)(CC(C)C)[H])=O)([C@](O)(C)[H])[H])C(C1=CC=CC=C1)=O |
SPLASH |
splash10-0a4i-0902000000-e206ef206f82982d8d35 |
Source of Spectrum |
QE-24-SM4-9 (DOI: 10.1002/chem.201703758) |
Wiley ID |
1901498 |