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2-Acetyl-6,6-dimethyl-3-phenyl-2,3,3a,4,6,7-hexahydropyrano[4,3-c]pyrazole
SpectraBase Compound ID DXuYvhFBOeI
InChI InChI=1S/C16H20N2O2/c1-11(19)18-15(12-7-5-4-6-8-12)13-10-20-16(2,3)9-14(13)17-18/h4-8,13,15H,9-10H2,1-3H3
InChIKey QLLDOMZBHXIMGG-UHFFFAOYSA-N
Mol Weight 272.35 g/mol
Molecular Formula C16H20N2O2
Exact Mass 272.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FzkGtqIFrF
Name 2-Acetyl-6,6-dimethyl-3-phenyl-2,3,3a,4,6,7-hexahydropyrano[4,3-c]pyrazole
Alternate Name(s) 1-(6,6-dimethyl-3-phenyl-3,3a,4,7-tetrahydropyrano[4,3-c]pyrazol-2-yl)ethanone Pyrazolo[4,3-c]pyrane, 2,3,3a,4,6,7-hexahydro-2-acetyl-6,6-dimethyl-3-phenyl-
CAS Registry Number 296247-05-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O2
InChI InChI=1S/C16H20N2O2/c1-11(19)18-15(12-7-5-4-6-8-12)13-10-20-16(2,3)9-14(13)17-18/h4-8,13,15H,9-10H2,1-3H3
InChIKey QLLDOMZBHXIMGG-UHFFFAOYSA-N
Molecular Weight 272.348 g/mol
SMILES c1ccc(C2C3COC(CC3=NN2C(=O)C)(C)C)cc1
SPLASH splash10-00dl-6920000000-17abf360a83d3e7732a6
Source of Spectrum AD-0-2532-0
Wiley ID 1430599