CAS Registry Number®
2096340-12-2
Molecular Formula
C13H18BNO5Molecular Mass
279.10Cite this Page
. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=2096340-12-2 (retrieved ) (CAS RN: 2096340-12-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C13H18BNO5/c1-13(2,3)20-12(16)15-6-7-19-11-5-4-9(14(17)18)8-10(11)15/h4-5,8,17-18H,6-7H2,1-3H3
InChIKey
InChIKey=TWQCRBQJOUVYBQ-UHFFFAOYSA-N
SMILES
C(OC(C)(C)C)(=O)N1C=2C(=CC=C(B(O)O)C2)OCC1
Canonical SMILES
O=C(OC(C)(C)C)N1C2=CC(=CC=C2OCC1)B(O)O
