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2-Propylnonanedioic acid

View entire compound with spectra: 2 MS (GC)

2-Propylnonanedioic acid
SpectraBase Compound ID CJH8WUYYug8
InChI InChI=1S/C12H22O4/c1-2-7-10(12(15)16)8-5-3-4-6-9-11(13)14/h10H,2-9H2,1H3,(H,13,14)(H,15,16)
InChIKey WIKIUKRKLSPEDN-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 6cfGj5IrChd
Name 2-Propylnonanedioic acid
Alternate Name(s) 2-Propylazelaic acid Nonanedioic acid, 2-propyl-
CAS Registry Number 10348-26-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-2-7-10(12(15)16)8-5-3-4-6-9-11(13)14/h10H,2-9H2,1H3,(H,13,14)(H,15,16)
InChIKey WIKIUKRKLSPEDN-UHFFFAOYSA-N
Molecular Weight 230.304 g/mol
SMILES OC(C(CCCCCCC(=O)O)CCC)=O
SPLASH splash10-0fl0-9500000000-8a3720f9944c29f8539e
Wiley ID 1491230