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Methyl cis-(1'R,2S)-2-(2',3'-dihydro-1'-hydroxy-3'-oxo-1'H-isoindol-2'-yl)-3-pentenoate
SpectraBase Compound ID CdzjCdZiqGU
InChI InChI=1S/C14H15NO4/c1-3-6-11(14(18)19-2)15-12(16)9-7-4-5-8-10(9)13(15)17/h3-9,11,17H,1-2H3/b6-3-/t9?,11-/m1/s1
InChIKey BXXZBIXNQOXLNT-GYCJQPFFSA-N
Mol Weight 261.28 g/mol
Molecular Formula C14H15NO4
Exact Mass 261.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9bcJ6vgAx9K
Name Methyl cis-(1'R,2S)-2-(2',3'-dihydro-1'-hydroxy-3'-oxo-1'H-isoindol-2'-yl)-3-pentenoate
CAS Registry Number 142796-79-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15NO4
InChI InChI=1S/C14H15NO4/c1-3-6-11(14(18)19-2)15-12(16)9-7-4-5-8-10(9)13(15)17/h3-9,11,17H,1-2H3/b6-3-/t9?,11-/m1/s1
InChIKey BXXZBIXNQOXLNT-GYCJQPFFSA-N
Molecular Weight 261.277 g/mol
SMILES OC=1N(C(C2C=CC=CC12)=O)[C@@](C(=O)OC)(\C=C/C)[H]
SPLASH splash10-0ab9-9310000000-83f0ee7486ff909c7d65
Source of Spectrum K-125-2473-3
Synonyms Methyl (2R,3Z)-2-(3-hydroxy-1-oxo-1,7a-dihydro-2H-isoindol-2-yl)-3-pentenoate
Wiley ID 1264733