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3-(4-(3-Chloro-1-oxopropyl)phenyl)propyl 2,2-dimethylpropanoate
SpectraBase Compound ID 4hegPwdQ3hQ
InChI InChI=1S/C17H23ClO3/c1-17(2,3)16(20)21-12-4-5-13-6-8-14(9-7-13)15(19)10-11-18/h6-9H,4-5,10-12H2,1-3H3
InChIKey VKDWQHIFBDNIBE-UHFFFAOYSA-N
Mol Weight 310.82 g/mol
Molecular Formula C17H23ClO3
Exact Mass 310.133572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5mxbosMUVa3
Name 3-(4-(3-Chloro-1-oxopropyl)phenyl)propyl 2,2-dimethylpropanoate
Alternate Name(s) 3-[4-(3-chloropropanoyl)phenyl]propyl pivalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23ClO3
InChI InChI=1S/C17H23ClO3/c1-17(2,3)16(20)21-12-4-5-13-6-8-14(9-7-13)15(19)10-11-18/h6-9H,4-5,10-12H2,1-3H3
InChIKey VKDWQHIFBDNIBE-UHFFFAOYSA-N
Molecular Weight 310.821 g/mol
SMILES C(C(C)(C)C)(=O)OCCCc1ccc(C(=O)CCCl)cc1
SPLASH splash10-0002-0910000000-8365dd37574bc8392678
Source of Spectrum F-55-12952-39
Wiley ID 839748