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1-Hydroxy-1-phenyl-2,2-trimethylene-heptan-3-one

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1-Hydroxy-1-phenyl-2,2-trimethylene-heptan-3-one
SpectraBase Compound ID 44BMj4N0IN6
InChI InChI=1S/C16H22O2/c1-2-3-10-14(17)16(11-7-12-16)15(18)13-8-5-4-6-9-13/h4-6,8-9,15,18H,2-3,7,10-12H2,1H3
InChIKey RIJLBPXWVIRBEP-UHFFFAOYSA-N
Mol Weight 246.35 g/mol
Molecular Formula C16H22O2
Exact Mass 246.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKIwJ9kXqwt
Name 1-[1-[hydroxy(phenyl)methyl]cyclobutyl]-1-pentanone
Alternate Name(s) 1-[1-[hydroxy(phenyl)methyl]cyclobutyl]pentan-1-one 1-[1-[oxidanyl(phenyl)methyl]cyclobutyl]pentan-1-one
CAS Registry Number 97234-41-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O2
InChI InChI=1S/C16H22O2/c1-2-3-10-14(17)16(11-7-12-16)15(18)13-8-5-4-6-9-13/h4-6,8-9,15,18H,2-3,7,10-12H2,1H3
InChIKey RIJLBPXWVIRBEP-UHFFFAOYSA-N
Molecular Weight 246.350 g/mol
SMILES OC(c1ccccc1)C1(C(=O)CCCC)CCC1
SPLASH splash10-0a4i-9500000000-4cca2d6c2b9124aa8448
Wiley ID 1478408