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Benzoic acid, 2-[[2-[5-[4-(2-ethoxy-2-oxoethoxy)phenyl]-2H-1,2,3,4-tetrazol-2-yl]acetyl]amino]-, methyl ester
SpectraBase Compound ID 7Jx0vIC5xHl
InChI InChI=1S/C21H21N5O6/c1-3-31-19(28)13-32-15-10-8-14(9-11-15)20-23-25-26(24-20)12-18(27)22-17-7-5-4-6-16(17)21(29)30-2/h4-11H,3,12-13H2,1-2H3,(H,22,27)
InChIKey IGUHBEYNOHCLRM-UHFFFAOYSA-N
Mol Weight 439.43 g/mol
Molecular Formula C21H21N5O6
Exact Mass 439.149183 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Yc2RtiQ5xB
Name Benzoic acid, 2-[[2-[5-[4-(2-ethoxy-2-oxoethoxy)phenyl]-2H-1,2,3,4-tetrazol-2-yl]acetyl]amino]-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21N5O6
InChI InChI=1S/C21H21N5O6/c1-3-31-19(28)13-32-15-10-8-14(9-11-15)20-23-25-26(24-20)12-18(27)22-17-7-5-4-6-16(17)21(29)30-2/h4-11H,3,12-13H2,1-2H3,(H,22,27)
InChIKey IGUHBEYNOHCLRM-UHFFFAOYSA-N
Molecular Weight 439.428 g/mol
SMILES N(c1ccccc1C(=O)OC)C(C[n]1nc(nn1)-c1ccc(cc1)OCC(OCC)=O)=O
SPLASH splash10-055e-3920000000-01eeaf449e10db2d6a2e
Source of Spectrum IY-1-4626-6
Synonyms 2-[[2-[5-[4-(2-ethoxy-2-oxoethoxy)phenyl]-2-tetrazolyl]-1-oxoethyl]amino]benzoic acid methyl ester Methyl 2-[[2-[5-[4-(2-ethoxy-2-oxoethoxy)phenyl]tetrazol-2-yl]acetyl]amino]benzoate Methyl 2-[[2-[5-[4-(2-ethoxy-2-oxo-ethoxy)phenyl]tetrazol-2-yl]acetyl]amino]benzoate Methyl 2-[2-[5-[4-(2-ethoxy-2-oxidanylidene-ethoxy)phenyl]-1,2,3,4-tetrazol-2-yl]ethanoylamino]benzoate
Wiley ID 1654249