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3-[(5-bromo-2-hydroxy-benzylidene)-amino]-1-phenyl-cyclopentanecarboxylic acid
SpectraBase Compound ID Evj1PoFwwZG
InChI InChI=1S/C19H18BrNO3/c20-15-6-7-17(22)13(10-15)12-21-16-8-9-19(11-16,18(23)24)14-4-2-1-3-5-14/h1-7,10,12,16,22H,8-9,11H2,(H,23,24)/b21-12+/t16-,19+/m0/s1
InChIKey VVKNUOVPMAEOLT-WKWJGNFBSA-N
Mol Weight 388.26 g/mol
Molecular Formula C19H18BrNO3
Exact Mass 387.047006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FIdqFsFfDgk
Name 3-[(5-bromo-2-hydroxy-benzylidene)-amino]-1-phenyl-cyclopentanecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18BrNO3
InChI InChI=1S/C19H18BrNO3/c20-15-6-7-17(22)13(10-15)12-21-16-8-9-19(11-16,18(23)24)14-4-2-1-3-5-14/h1-7,10,12,16,22H,8-9,11H2,(H,23,24)/b21-12+/t16-,19+/m0/s1
InChIKey VVKNUOVPMAEOLT-WKWJGNFBSA-N
Molecular Weight 388.261 g/mol
SMILES OC([C@]1(C[C@@](\N=C\c2c(ccc(c2)Br)O)(CC1)[H])c1ccccc1)=O
SPLASH splash10-0006-5922000000-a50dd9c302a09e5ed700
Synonyms (1R,3S)-3-{[(E)-(5-bromo-2-hydroxyphenyl)methylidene]amino}-1-phenylcyclopentanecarboxylic acid 3-{[(5-bromo-2-hydroxyphenyl)methylidene]amino}-1-phenylcyclopentanecarboxylic acid
Wiley ID 1452344