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4-Nitrobenzoic acid (2-keto-1-p-anisyl-propyl) ester
SpectraBase Compound ID tmZNgkdLnO
InChI InChI=1S/C18H17NO6/c1-12(20)17(11-13-3-9-16(24-2)10-4-13)25-18(21)14-5-7-15(8-6-14)19(22)23/h3-10,17H,11H2,1-2H3
InChIKey HBXDKSGIGLEKER-UHFFFAOYSA-N
Mol Weight 343.34 g/mol
Molecular Formula C18H17NO6
Exact Mass 343.105587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5w77Khnc9Jv
Name 4-Nitrobenzoic acid (2-keto-1-p-anisyl-propyl) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO6
InChI InChI=1S/C18H17NO6/c1-12(20)17(11-13-3-9-16(24-2)10-4-13)25-18(21)14-5-7-15(8-6-14)19(22)23/h3-10,17H,11H2,1-2H3
InChIKey HBXDKSGIGLEKER-UHFFFAOYSA-N
Molecular Weight 343.335 g/mol
SMILES c1(N(=O)=O)ccc(C(OC(C(=O)C)Cc2ccc(cc2)OC)=O)cc1
SPLASH splash10-0udi-2900000000-d48888fc1e3e3b0140b0
Source of Spectrum MZ-34-2726-10
Synonyms 4-Nitrobenzoic acid [1-(4-methoxyphenyl)-3-oxobutan-2-yl] ester [1-(4-methoxyphenyl)-3-oxobutan-2-yl] 4-nitrobenzoate [1-[(4-methoxyphenyl)methyl]-2-oxo-propyl] 4-nitrobenzoate
Wiley ID 1582540