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3-(2-Chlorophenyl)propanal
SpectraBase Compound ID ErWTFI3nOMb
InChI InChI=1S/C9H9ClO/c10-9-6-2-1-4-8(9)5-3-7-11/h1-2,4,6-7H,3,5H2
InChIKey GCADRZXDZQALMW-UHFFFAOYSA-N
Mol Weight 168.62 g/mol
Molecular Formula C9H9ClO
Exact Mass 168.034193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1bOiJA7TlY
Name 3-(2-chlorophenyl)propanal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 168.034192609 u
Formula C9H9ClO
InChI InChI=1S/C9H9ClO/c10-9-6-2-1-4-8(9)5-3-7-11/h1-2,4,6-7H,3,5H2
InChIKey GCADRZXDZQALMW-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202003640
Molecular Weight 168.623 g/mol
Quality 907
SMILES C1=CC(=C(C=C1)Cl)CCC=O
SPLASH splash10-0fc0-7900000000-3aa63efbb9f81835da5c
Source of Spectrum QE-27-SM17-4m (DOI: 10.1002/chem.202003640)
Wiley ID 1904343