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2H-Isoindole-2-acetic-.alpha.-d acid, 1,3-dihydro-1,3-dioxo-, (S)-
SpectraBase Compound ID 1CtiQmdDBRj
InChI InChI=1S/C10H7NO4/c12-8(13)5-11-9(14)6-3-1-2-4-7(6)10(11)15/h1-4H,5H2,(H,12,13)/i5D/t5-/m0/s1
InChIKey WQINSVOOIJDOLJ-ITOSGJDPSA-N
Mol Weight 206.18 g/mol
Molecular Formula C10H62DNO4
Exact Mass 206.043784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yeLvxqAcCw
Name 2H-Isoindole-2-acetic-.alpha.-d acid, 1,3-dihydro-1,3-dioxo-, (S)-
Alternate Name(s) (+)-(S)-N-Phthaloyl(2-D1)glycine (2S)-2-deuterio-2-(1,3-dioxo-2-isoindolyl)acetic acid (2S)-2-deuterio-2-(1,3-dioxoisoindol-2-yl)acetic acid (2S)-2-deuterio-2-(1,3-dioxoisoindolin-2-yl)acetic acid (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-deuterio-ethanoic acid
CAS Registry Number 62061-63-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H6DNO4
InChI InChI=1S/C10H7NO4/c12-8(13)5-11-9(14)6-3-1-2-4-7(6)10(11)15/h1-4H,5H2,(H,12,13)/i5D/t5-/m0/s1
InChIKey WQINSVOOIJDOLJ-ITOSGJDPSA-N
Molecular Weight 206.175 g/mol
SMILES OC([C@@](N1C(c2ccccc2C1=O)=O)([2D])[H])=O
SPLASH splash10-0a4i-0090000000-dea52165ea4ad998c96a
Source of Spectrum KC-1976-2235-0
Wiley ID 1203258