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2,2-PENTAMETHYLENE-1,2,3,4-TETRAHYDROQUINAZOLIN-4-ONE

View entire compound with spectra: 2 NMR, and 4 MS (GC)

2,2-PENTAMETHYLENE-1,2,3,4-TETRAHYDROQUINAZOLIN-4-ONE
SpectraBase Compound ID 8jfQVg8R6Z9
InChI InChI=1S/C13H16N2O/c16-12-10-6-2-3-7-11(10)14-13(15-12)8-4-1-5-9-13/h2-3,6-7,14H,1,4-5,8-9H2,(H,15,16)
InChIKey LUDINISIACCKKZ-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C13H16N2O
Exact Mass 216.126263 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAkeugKIFwR
Name 4-Spiro[1,3-dihydroquinazoline-2,1'-cyclohexane]one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O
InChI InChI=1S/C13H16N2O/c16-12-10-6-2-3-7-11(10)14-13(15-12)8-4-1-5-9-13/h2-3,6-7,14H,1,4-5,8-9H2,(H,15,16)
InChIKey LUDINISIACCKKZ-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c3gc42400f
Molecular Weight 216.284 g/mol
SMILES N1C2(CCCCC2)NC(c2ccccc12)=O
SPLASH splash10-00di-0910000000-496220ad32b1618d86fe
Source of Spectrum GCH-16-3210/SM21-Table5,entry21
Synonyms Spiro[1,3-dihydroquinazoline-2,1'-cyclohexane]-4-one 1'H-Spiro[cyclohexane-1,2'-quinazolin]-4'(3'H)-one
Wiley ID 1755341