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1-Methoxycarbonyl-4-phenyl-2,3,7-triazabicyclo[3.3.0]oct-3-ene
SpectraBase Compound ID 1R17pX1Di4z
InChI InChI=1S/C13H15N3O2/c1-18-12(17)13-8-14-7-10(13)11(15-16-13)9-5-3-2-4-6-9/h2-6,10,14,16H,7-8H2,1H3
InChIKey VLMHKEHDXXYYDR-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C13H15N3O2
Exact Mass 245.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CV63XuueITK
Name 1-Methoxycarbonyl-4-phenyl-2,3,7-triazabicyclo[3.3.0]oct-3-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15N3O2
InChI InChI=1S/C13H15N3O2/c1-18-12(17)13-8-14-7-10(13)11(15-16-13)9-5-3-2-4-6-9/h2-6,10,14,16H,7-8H2,1H3
InChIKey VLMHKEHDXXYYDR-UHFFFAOYSA-N
Molecular Weight 245.282 g/mol
SMILES N1N=C(C2CNCC12C(=O)OC)c1ccccc1
SPLASH splash10-0fk9-0970000000-10b8efbc06827092fa1b
Source of Spectrum QA-49-99-7cu
Synonyms Methyl 3-phenyl-3a,4,5,6-tetrahydropyrrolo[3,4-c]pyrazole-6a(1H)-carboxylate
Wiley ID 1795549