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3-Phenyl-4-(3a,5,6,6a-tetrahydrocyclopenta[d]isoxazol-4-on-3-yl)sydnone
SpectraBase Compound ID Chj8tFuRB7v
InChI InChI=1S/C14H11N3O4/c18-9-6-7-10-11(9)12(15-20-10)13-14(19)21-16-17(13)8-4-2-1-3-5-8/h1-5,10-11H,6-7H2
InChIKey AMYZYTLVJKCWBH-UHFFFAOYSA-N
Mol Weight 285.26 g/mol
Molecular Formula C14H11N3O4
Exact Mass 285.074956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KfWfkYtqXZ
Name 3-Phenyl-4-(3a,5,6,6a-tetrahydrocyclopenta[d]isoxazol-4-on-3-yl)sydnone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11N3O4
InChI InChI=1S/C14H11N3O4/c18-9-6-7-10-11(9)12(15-20-10)13-14(19)21-16-17(13)8-4-2-1-3-5-8/h1-5,10-11H,6-7H2
InChIKey AMYZYTLVJKCWBH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100169
Molecular Weight 285.259 g/mol
SMILES c1([n+](noc1[O-])-c1ccccc1)C1=NOC2C1C(CC2)=O
SPLASH splash10-004i-9240000000-fc238711df34254d3506
Source of Spectrum QA-48-1148-5a
Synonyms 4-(4-oxo-3a,5,6,6a-tetrahydro-4H-cyclopenta[d]isoxazol-3-yl)-3-phenyl-1,2,3-oxadiazol-3-ium-5-olate
Wiley ID 1795507