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3-amino-4-[(E)-3-phenylprop-2-enyl]-1,2,4-oxadiazol-5-one
SpectraBase Compound ID I7iamz3b0aY
InChI InChI=1S/C11H11N3O2/c12-10-13-16-11(15)14(10)8-4-7-9-5-2-1-3-6-9/h1-7H,8H2,(H2,12,13)/b7-4+
InChIKey XAMLINKNQAJFHG-QPJJXVBHSA-N
Mol Weight 217.23 g/mol
Molecular Formula C11H11N3O2
Exact Mass 217.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LiIVLPoSs6N
Name 3-amino-4-[(E)-3-phenylprop-2-enyl]-1,2,4-oxadiazol-5-one
Alternate Name(s) 3-amino-4-[(E)-cinnamyl]-1,2,4-oxadiazol-5-one 3-azanyl-4-[(E)-3-phenylprop-2-enyl]-1,2,4-oxadiazol-5-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N3O2
InChI InChI=1S/C11H11N3O2/c12-10-13-16-11(15)14(10)8-4-7-9-5-2-1-3-6-9/h1-7H,8H2,(H2,12,13)/b7-4+
InChIKey XAMLINKNQAJFHG-QPJJXVBHSA-N
Molecular Weight 217.228 g/mol
SMILES NC1=NOC(N1C\C=C\c1ccccc1)=O
SPLASH splash10-014i-0390000000-1a98c795e00da850f776
Source of Spectrum D8-329-539-6
Wiley ID 1516307