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3-(4'-Methylphenyl)-4-(1-oxa-2-aza-spiro[4.5]dec-2-en-3-yl)sydnone
SpectraBase Compound ID 3vmIuEXJWgU
InChI InChI=1S/C17H19N3O3/c1-12-5-7-13(8-6-12)20-15(16(21)22-19-20)14-11-17(23-18-14)9-3-2-4-10-17/h5-8H,2-4,9-11H2,1H3
InChIKey BRBSDAFMVMFSEV-UHFFFAOYSA-N
Mol Weight 313.36 g/mol
Molecular Formula C17H19N3O3
Exact Mass 313.142641 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FoUfaoaZ22L
Name 3-(4'-Methylphenyl)-4-(1-oxa-2-aza-spiro[4.5]dec-2-en-3-yl)sydnone
Alternate Name(s) 4-(1-oxa-2-azaspiro[4.5]dec-2-en-3-yl)-3-(p-tolyl)-1,2,3-oxadiazol-3-ium-5-olate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19N3O3
InChI InChI=1S/C17H19N3O3/c1-12-5-7-13(8-6-12)20-15(16(21)22-19-20)14-11-17(23-18-14)9-3-2-4-10-17/h5-8H,2-4,9-11H2,1H3
InChIKey BRBSDAFMVMFSEV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100169
Molecular Weight 313.357 g/mol
SMILES c1([n+](noc1[O-])-c1ccc(cc1)C)C1=NOC2(C1)CCCCC2
SPLASH splash10-0a4l-6491000000-cd966f0e8d954a64004b
Source of Spectrum QA-48-1151-10b
Wiley ID 1795502