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4-n-Heptylbenzoyl chloride
SpectraBase Compound ID 4TUm9sVBQMi
InChI InChI=1S/C14H19ClO/c1-2-3-4-5-6-7-12-8-10-13(11-9-12)14(15)16/h8-11H,2-7H2,1H3
InChIKey WHTFLTOKFXTJGV-UHFFFAOYSA-N
Mol Weight 238.76 g/mol
Molecular Formula C14H19ClO
Exact Mass 238.112443 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4h0O3rg1ilz
Name Benzoyl chloride, 4-heptyl-
CAS Registry Number 50606-96-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19ClO
InChI InChI=1S/C14H19ClO/c1-2-3-4-5-6-7-12-8-10-13(11-9-12)14(15)16/h8-11H,2-7H2,1H3
InChIKey WHTFLTOKFXTJGV-UHFFFAOYSA-N
Molecular Weight 238.758 g/mol
SMILES c1cc(ccc1C(=O)Cl)CCCCCCC
SPLASH splash10-0udi-8390000000-9d997dd0e79c41753bf4
Source of Spectrum W6-21308-0-0
Synonyms 4-Heptylbenzoyl chloride 4-n-Heptylbenzoyl chloride p-Heptylbenzoyl chloride EINECS 256-648-1
Wiley ID 99705