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2-(2-benzyl-3-keto-3-methoxy-propyl)benzoic acid methyl ester
SpectraBase Compound ID DjYEMKhDbnU
InChI InChI=1S/C19H20O4/c1-22-18(20)16(12-14-8-4-3-5-9-14)13-15-10-6-7-11-17(15)19(21)23-2/h3-11,16H,12-13H2,1-2H3
InChIKey KXYNIWSTCAWPES-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C19H20O4
Exact Mass 312.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LT05pnc0hx8
Name 2-(2-benzyl-3-keto-3-methoxy-propyl)benzoic acid methyl ester
Alternate Name(s) 2-[3-methoxy-3-oxo-2-(phenylmethyl)propyl]benzoic acid methyl ester Methyl 2-(2-benzyl-3-methoxy-3-oxo-propyl)benzoate Methyl 2-[3-methoxy-3-oxidanylidene-2-(phenylmethyl)propyl]benzoate
CAS Registry Number 125868-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O4
InChI InChI=1S/C19H20O4/c1-22-18(20)16(12-14-8-4-3-5-9-14)13-15-10-6-7-11-17(15)19(21)23-2/h3-11,16H,12-13H2,1-2H3
InChIKey KXYNIWSTCAWPES-UHFFFAOYSA-N
Molecular Weight 312.365 g/mol
SMILES c1(c(C(=O)OC)cccc1)CC(C(=O)OC)Cc1ccccc1
SPLASH splash10-0006-9431000000-3ea93ea5f8eede6cf4d0
Source of Spectrum AH-120-614-18
Wiley ID 1313509