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Heptanedioic-2,2,6,6-D4 acid, dimethyl ester
SpectraBase Compound ID 5t3SxCIPyM3
InChI InChI=1S/C9H16O4/c1-12-8(10)6-4-3-5-7-9(11)13-2/h3-7H2,1-2H3/i6D2,7D2
InChIKey SHWINQXIGSEZAP-KXGHAPEVSA-N
Mol Weight 192.25 g/mol
Molecular Formula C9H122D4O4
Exact Mass 192.129966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EztNM4YupZ
Name Heptanedioic-2,2,6,6-D4 acid, dimethyl ester
CAS Registry Number 120811-82-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12D4O4
InChI InChI=1S/C9H16O4/c1-12-8(10)6-4-3-5-7-9(11)13-2/h3-7H2,1-2H3/i6D2,7D2
InChIKey SHWINQXIGSEZAP-KXGHAPEVSA-N
Molecular Weight 192.247 g/mol
SMILES C(=O)(OC)C(CCCC(C(=O)OC)([2D])[2D])([2D])[2D]
SPLASH splash10-0axr-9600000000-e6156946e0e30f4f4dc3
Source of Spectrum O-23-724-14
Synonyms 2,2,6,6-Tetradeuterioheptanedioic acid dimethyl ester
Wiley ID 1184438