CAS Registry Number: 83467-34-9

Name:

4-​Isoxazoleethanol, 3,​5-​dimethyl-

Chemical Formula: C7H11NO2
Exact Mass: 141.08
Molecular Weight: 141.17
m/z: 141.08 (100.0%), 142.08 (8.0%)
Elemental Analysis: C, 59.56; H, 7.85; N, 9.92; O, 22.67

InChI: InChI=1S/C7H11NO2/c1-5-7(3-4-9)6(2)10-8-5/h9H,3-4H2,1-2H3
InChIKey: QVSACOUKYXVIGR-UHFFFAOYSA-N
Canonical SMILES : CC1=C(C(=NO1)C)CCO

Specification

98%

1. (1) Zefirov, N. S.; Tetrahedron 1982, V38(11), P1693-7 CAPLUS