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4-[4-(cyclohexylcarbonylamino)phenoxy]phthalic acid
SpectraBase Compound ID 27oeYm4Ij5w
InChI InChI=1S/C21H21NO6/c23-19(13-4-2-1-3-5-13)22-14-6-8-15(9-7-14)28-16-10-11-17(20(24)25)18(12-16)21(26)27/h6-13H,1-5H2,(H,22,23)(H,24,25)(H,26,27)
InChIKey YHVGYTUAMDXNPU-UHFFFAOYSA-N
Mol Weight 383.4 g/mol
Molecular Formula C21H21NO6
Exact Mass 383.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B43DahWYFVo
Name 4-[4-(cyclohexylcarbonylamino)phenoxy]phthalic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO6
InChI InChI=1S/C21H21NO6/c23-19(13-4-2-1-3-5-13)22-14-6-8-15(9-7-14)28-16-10-11-17(20(24)25)18(12-16)21(26)27/h6-13H,1-5H2,(H,22,23)(H,24,25)(H,26,27)
InChIKey YHVGYTUAMDXNPU-UHFFFAOYSA-N
Molecular Weight 383.400 g/mol
SMILES OC(c1c(cc(Oc2ccc(NC(=O)C3CCCCC3)cc2)cc1)C(=O)O)=O
SPLASH splash10-0a59-9441000000-ce08771e3722dc4cebd1
Synonyms 4-[4-[[cyclohexyl(oxo)methyl]amino]phenoxy]phthalic acid
Wiley ID 1450822