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2-Phenylethyl 2-formylbenzoate
SpectraBase Compound ID CZ6T99I76Ub
InChI InChI=1S/C16H14O3/c17-12-14-8-4-5-9-15(14)16(18)19-11-10-13-6-2-1-3-7-13/h1-9,12H,10-11H2
InChIKey KQNMLAVTNUFBMY-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C16H14O3
Exact Mass 254.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GEqMOmwnt2L
Name 2-Phenylethyl 2-formylbenzoate
Alternate Name(s) 2-formylbenzoic acid 2-phenylethyl ester 2-Phenylethyl 2-methanoylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O3
InChI InChI=1S/C16H14O3/c17-12-14-8-4-5-9-15(14)16(18)19-11-10-13-6-2-1-3-7-13/h1-9,12H,10-11H2
InChIKey KQNMLAVTNUFBMY-UHFFFAOYSA-N
Molecular Weight 254.285 g/mol
SMILES C(c1c(C=O)cccc1)(=O)OCCc1ccccc1
SPLASH splash10-0udi-2900000000-be1dcf7f03f5c04f47bc
Source of Spectrum H-86-2890-1
Wiley ID 1525648