SpectraBase Spectrum ID |
BaO6TuyqOAE |
Name |
Erythro-3-(4-chloropheny)-5-(2,2-dimethyl-1,3-dioxalanyl)-.delta.(2)-isoxazoline |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
281.081871076 u |
Formula |
C14H16ClNO3 |
InChI |
InChI=1S/C14H16ClNO3/c1-14(2)17-8-13(18-14)12-7-11(16-19-12)9-3-5-10(15)6-4-9/h3-6,12-13H,7-8H2,1-2H3/t12?,13-/m1/s1 |
InChIKey |
KDXAYITWILXLHX-ZGTCLIOFSA-N |
Molecular Weight |
281.739 g/mol |
SMILES |
C1(=NOC(C1)[C@@]1(OC(C)(C)OC1)[H])C1=CC=C(C=C1)Cl |