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4-(1-hydroxyethyl)-3-(4-methoxyphenyl)-1,2,3-oxadiazol-3-ium-5-olate
SpectraBase Compound ID JMIawWiRhe1
InChI InChI=1S/C11H12N2O4/c1-7(14)10-11(15)17-12-13(10)8-3-5-9(16-2)6-4-8/h3-7,14H,1-2H3
InChIKey KFYFFTXKXMGZKY-UHFFFAOYSA-N
Mol Weight 236.23 g/mol
Molecular Formula C11H12N2O4
Exact Mass 236.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ebpb8uR3Tjr
Name 4-(1-hydroxyethyl)-3-(4-methoxyphenyl)-1,2,3-oxadiazol-3-ium-5-olate
Alternate Name(s) 4-(1-hydroxyethyl)-3-(4-methoxyphenyl)-5-oxadiazol-3-iumolate
Comments Less than 3 mono-isotopic peaks
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Formula C11H12N2O4
InChI InChI=1S/C11H12N2O4/c1-7(14)10-11(15)17-12-13(10)8-3-5-9(16-2)6-4-8/h3-7,14H,1-2H3
InChIKey KFYFFTXKXMGZKY-UHFFFAOYSA-N
Molecular Weight 236.227 g/mol
SMILES OC(c1[n+](noc1[O-])-c1ccc(cc1)OC)C
SPLASH splash10-001i-0900000000-1188ed7c2f7e3840b319
Source of Spectrum QA-42-988-4
Wiley ID 862107