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2-(chloromethyl)-3H-spiro[benzo[h]quinazoline-5,1'-cyclopentan]-4(6H)-one
SpectraBase Compound ID 1WapPqQ8rna
InChI InChI=1S/C17H17ClN2O/c18-10-13-19-15-12-6-2-1-5-11(12)9-17(7-3-4-8-17)14(15)16(21)20-13/h1-2,5-6H,3-4,7-10H2,(H,19,20,21)
InChIKey LEQVNCSENKLUDJ-UHFFFAOYSA-N
Mol Weight 300.79 g/mol
Molecular Formula C17H17ClN2O
Exact Mass 300.102941 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68xqkoWVFS9
Name 1,3-Penantrolin-4(3H)-one, 5,6-dihydro-2-chloromethyl-spiro-5-cyclopentane-
CAS Registry Number 317840-42-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17ClN2O
InChI InChI=1S/C17H17ClN2O/c18-10-13-19-15-12-6-2-1-5-11(12)9-17(7-3-4-8-17)14(15)16(21)20-13/h1-2,5-6H,3-4,7-10H2,(H,19,20,21)
InChIKey LEQVNCSENKLUDJ-UHFFFAOYSA-N
Molecular Weight 300.789 g/mol
SMILES N1C(=NC2=C(C1=O)C1(Cc3ccccc23)CCCC1)CCl
SPLASH splash10-0ab9-5791000000-10608e4486ef8b7baf04
Source of Spectrum AD-0-2532-0
Synonyms 2-(chloromethyl)-4-spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]one 2-(chloromethyl)spiro[1,6-dihydrobenzo[h]quinazoline-5,1'-cyclopentane]-4-one
Wiley ID 1426136