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3H-Benzo[b]cyclobuta[d]pyran-3-one, 2a-acetyl-1,2,2a,8b-tetrahydro-1-(4-pyridinyl)-
SpectraBase Compound ID 60R3wf8KcGJ
InChI InChI=1S/C18H15NO3/c1-11(20)18-10-14(12-6-8-19-9-7-12)16(18)13-4-2-3-5-15(13)22-17(18)21/h2-9,14,16H,10H2,1H3
InChIKey OZXSHVLORGYAHB-UHFFFAOYSA-N
Mol Weight 293.32 g/mol
Molecular Formula C18H15NO3
Exact Mass 293.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B5SIF4hYl4Y
Name 3H-Benzo[b]cyclobuta[d]pyran-3-one, 2a-acetyl-1,2,2a,8b-tetrahydro-1-(4-pyridinyl)-
Alternate Name(s) 2a-acetyl-1-(4-pyridinyl)-1,2,2a,8b-tetrahydro-3H-cyclobuta[c]chromen-3-one 2a-acetyl-1-(pyrid-4-yl)-1,2,2a,8b-tetrahydro-cyclobuta(c)cumarin
CAS Registry Number 59743-98-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO3
InChI InChI=1S/C18H15NO3/c1-11(20)18-10-14(12-6-8-19-9-7-12)16(18)13-4-2-3-5-15(13)22-17(18)21/h2-9,14,16H,10H2,1H3
InChIKey OZXSHVLORGYAHB-UHFFFAOYSA-N
Molecular Weight 293.322 g/mol
SMILES C12(C(Oc3c(C2C(C1)c1ccncc1)cccc3)=O)C(=O)C
SPLASH splash10-0uki-3950000000-4b4b5a820ca3e32b810f
Source of Spectrum H-59-838-6
Wiley ID 1296440