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4-[4-Chlorotetrahydro-2H-pyranyl]benzonitrile
SpectraBase Compound ID 5BgwcFD0SIs
InChI InChI=1S/C12H12ClNO/c13-11-5-6-15-12(7-11)10-3-1-9(8-14)2-4-10/h1-4,11-12H,5-7H2
InChIKey HPZOCPWGBGGJKT-UHFFFAOYSA-N
Mol Weight 221.69 g/mol
Molecular Formula C12H12ClNO
Exact Mass 221.060742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BXyzACTkEoB
Name 4-[4-Chlorotetrahydro-2H-pyranyl]benzonitrile
Alternate Name(s) 4-(4-Chlorotetrahydro-2H-pyran-2-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12ClNO
InChI InChI=1S/C12H12ClNO/c13-11-5-6-15-12(7-11)10-3-1-9(8-14)2-4-10/h1-4,11-12H,5-7H2
InChIKey HPZOCPWGBGGJKT-UHFFFAOYSA-N
Molecular Weight 221.687 g/mol
SMILES C(c1ccc(cc1)C1CC(CCO1)Cl)#N
SPLASH splash10-0a59-6900000000-f6a95b46b4927e084b45
Source of Spectrum C5-2004-2713-3
Wiley ID 1617486