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Benzenepropanoic acid, 4-(cyclopentyloxy)-.beta.-[(9H-xanthen-9-ylcarbonyl)amino]-
SpectraBase Compound ID 1sPBCSE35JO
InChI InChI=1S/C28H27NO5/c30-26(31)17-23(18-13-15-20(16-14-18)33-19-7-1-2-8-19)29-28(32)27-21-9-3-5-11-24(21)34-25-12-6-4-10-22(25)27/h3-6,9-16,19,23,27H,1-2,7-8,17H2,(H,29,32)(H,30,31)
InChIKey GJJPUMALIUKIFJ-UHFFFAOYSA-N
Mol Weight 457.53 g/mol
Molecular Formula C28H27NO5
Exact Mass 457.188923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6U3HvGzn9x0
Name Benzenepropanoic acid, 4-(cyclopentyloxy)-.beta.-[(9H-xanthen-9-ylcarbonyl)amino]-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H27NO5
InChI InChI=1S/C28H27NO5/c30-26(31)17-23(18-13-15-20(16-14-18)33-19-7-1-2-8-19)29-28(32)27-21-9-3-5-11-24(21)34-25-12-6-4-10-22(25)27/h3-6,9-16,19,23,27H,1-2,7-8,17H2,(H,29,32)(H,30,31)
InChIKey GJJPUMALIUKIFJ-UHFFFAOYSA-N
Molecular Weight 457.526 g/mol
SMILES OC(CC(c1ccc(cc1)OC1CCCC1)NC(=O)C1c2c(cccc2)Oc2c1cccc2)=O
SPLASH splash10-001i-1900000000-feaf37e673615f45c398
Source of Spectrum IY-1-4654-0
Synonyms 3-(4-cyclopentyloxyphenyl)-3-[[oxo(9H-xanthen-9-yl)methyl]amino]propanoic acid 3-(4-cyclopentyloxyphenyl)-3-(9H-xanthene-9-carbonylamino)propanoic acid 3-[4-(cyclopentoxy)phenyl]-3-(9H-xanthene-9-carbonylamino)propanoic acid 3-(4-cyclopentyloxyphenyl)-3-(9H-xanthen-9-ylcarbonylamino)propanoic acid
Wiley ID 1654523