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3-Isopropyl-5-(4-methoxyphenyl)-1,3,4-oxadiazol-2(3H)-one
SpectraBase Compound ID C6cK4nWAXA
InChI InChI=1S/C12H14N2O3/c1-8(2)14-12(15)17-11(13-14)9-4-6-10(16-3)7-5-9/h4-8H,1-3H3
InChIKey CBAKOOAKUDDCJR-UHFFFAOYSA-N
Mol Weight 234.25 g/mol
Molecular Formula C12H14N2O3
Exact Mass 234.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FOutWjpIW
Name 3-Isopropyl-5-(4-methoxyphenyl)-1,3,4-oxadiazol-2(3H)-one
CAS Registry Number 41126-08-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14N2O3
InChI InChI=1S/C12H14N2O3/c1-8(2)14-12(15)17-11(13-14)9-4-6-10(16-3)7-5-9/h4-8H,1-3H3
InChIKey CBAKOOAKUDDCJR-UHFFFAOYSA-N
Molecular Weight 234.255 g/mol
SMILES CC(C)N1C(=O)OC(c2ccc(cc2)OC)=N1
SPLASH splash10-001l-2930000000-afd47c0ca9fa719e3aca
Source of Spectrum O-11-720-9
Synonyms 2-p-Methoxyphenyl-4-isopropyl-oxadiazol-1,3,4-one-5 3-isopropyl-5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-one 5-(4-Methoxyphenyl)-3-propan-2-yl-1,3,4-oxadiazol-2-one
Wiley ID 1235746