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4-Butylbenzoic acid, 4-nitrophenyl ester
SpectraBase Compound ID 5O9rJ36BEJ8
InChI InChI=1S/C17H17NO4/c1-2-3-4-13-5-7-14(8-6-13)17(19)22-16-11-9-15(10-12-16)18(20)21/h5-12H,2-4H2,1H3
InChIKey VVCMTMMBNVKTTG-UHFFFAOYSA-N
Mol Weight 299.33 g/mol
Molecular Formula C17H17NO4
Exact Mass 299.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FzUuLxST22u
Name 4-Butylbenzoic acid, 4-nitrophenyl ester
Alternate Name(s) (4-nitrophenyl) 4-butylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO4
InChI InChI=1S/C17H17NO4/c1-2-3-4-13-5-7-14(8-6-13)17(19)22-16-11-9-15(10-12-16)18(20)21/h5-12H,2-4H2,1H3
InChIKey VVCMTMMBNVKTTG-UHFFFAOYSA-N
Molecular Weight 299.326 g/mol
SMILES CCCCc1ccc(cc1)C(=O)Oc1ccc(cc1)N(=O)=O
SPLASH splash10-03di-2900000000-160f7947ef8baacf43e7
Source of Spectrum NP-10-464-0
Wiley ID 1108585