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2H-Pyran-2-one, 3-[(4-chlorophenyl)-1-piperidinylmethyl]-4-hydroxy-6-methyl-
SpectraBase Compound ID 3M73U7M0cHP
InChI InChI=1S/C18H20ClNO3/c1-12-11-15(21)16(18(22)23-12)17(20-9-3-2-4-10-20)13-5-7-14(19)8-6-13/h5-8,11,17,21H,2-4,9-10H2,1H3
InChIKey NCFKTJZCSPKCMV-UHFFFAOYSA-N
Mol Weight 333.82 g/mol
Molecular Formula C18H20ClNO3
Exact Mass 333.113171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LPWqUjg2IaG
Name 2H-Pyran-2-one, 3-[(4-chlorophenyl)-1-piperidinylmethyl]-4-hydroxy-6-methyl-
Alternate Name(s) 3-(4-Chloro-.alpha.-piperidinobenzyl)-4-hydroxy-6-methyl-2-pyrone 3-[(4-chlorophenyl)(1-piperidinyl)methyl]-4-hydroxy-6-methyl-2H-pyran-2-one 3-[(4-chlorophenyl)-(1-piperidinyl)methyl]-4-hydroxy-6-methyl-2-pyranone 3-[(4-chlorophenyl)-piperidin-1-ylmethyl]-4-hydroxy-6-methylpyran-2-one 3-[(4-chlorophenyl)-(1-piperidyl)methyl]-4-hydroxy-6-methyl-pyran-2-one 3-[(4-chlorophenyl)-piperidin-1-yl-methyl]-6-methyl-4-oxidanyl-pyran-2-one
CAS Registry Number 106148-30-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20ClNO3
InChI InChI=1S/C18H20ClNO3/c1-12-11-15(21)16(18(22)23-12)17(20-9-3-2-4-10-20)13-5-7-14(19)8-6-13/h5-8,11,17,21H,2-4,9-10H2,1H3
InChIKey NCFKTJZCSPKCMV-UHFFFAOYSA-N
Molecular Weight 333.815 g/mol
SMILES OC1=C(C(OC(=C1)C)=O)C(N1CCCCC1)c1ccc(cc1)Cl
SPLASH splash10-01q3-9430000000-441ab50b350e422e195b
Source of Spectrum Y-23-415-2
Wiley ID 1330197