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1H-Isoindole-1,3(2H)-dione, 2,2'-(1,6-hexanediyl-3,3,4,4-D4)bis-
SpectraBase Compound ID IB46IGmEdGE
InChI InChI=1S/C22H20N2O4/c25-19-15-9-3-4-10-16(15)20(26)23(19)13-7-1-2-8-14-24-21(27)17-11-5-6-12-18(17)22(24)28/h3-6,9-12H,1-2,7-8,13-14H2/i1D2,2D2
InChIKey MJYXMZHGVMGKLG-LNLMKGTHSA-N
Mol Weight 380.44 g/mol
Molecular Formula C22H162D4N2O4
Exact Mass 380.167414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IqvWvx3bJqP
Name 1H-Isoindole-1,3(2H)-dione, 2,2'-(1,6-hexanediyl-3,3,4,4-D4)bis-
CAS Registry Number 72651-92-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16D4N2O4
InChI InChI=1S/C22H20N2O4/c25-19-15-9-3-4-10-16(15)20(26)23(19)13-7-1-2-8-14-24-21(27)17-11-5-6-12-18(17)22(24)28/h3-6,9-12H,1-2,7-8,13-14H2/i1D2,2D2
InChIKey MJYXMZHGVMGKLG-LNLMKGTHSA-N
Molecular Weight 380.436 g/mol
SMILES C1(N(C(c2ccccc12)=O)CCC(C(CCN1C(c2ccccc2C1=O)=O)([2D])[2D])([2D])[2D])=O
SPLASH splash10-03e9-0913000000-76d80fdabd99866b61e3
Source of Spectrum H-62-2232-4
Synonyms 3,3,4,4-D4-Hexane-1,6-diphthalimide
Wiley ID 118998