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Dimethyl 2-propylheptanedioate
SpectraBase Compound ID 7TJOQPD73mK
InChI InChI=1S/C12H22O4/c1-4-7-10(12(14)16-3)8-5-6-9-11(13)15-2/h10H,4-9H2,1-3H3
InChIKey FTDNFRCIZCKCQR-UHFFFAOYSA-N
Mol Weight 230.3 g/mol
Molecular Formula C12H22O4
Exact Mass 230.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOzRYrCSQ9f
Name HEPTANEDIOIC ACID, 2-PROPYL-, DIMETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-4-7-10(12(14)16-3)8-5-6-9-11(13)15-2/h10H,4-9H2,1-3H3
InChIKey FTDNFRCIZCKCQR-UHFFFAOYSA-N
Instrument Name CH7
Molecular Weight 230.1512
SMILES CCCC(CCCCC(OC)=O)C(OC)=O
SPLASH splash10-0ap3-9300000000-f91f1fc41f5f40a5359f
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany