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Propanedioic acid, (1-cyclohexen-1-ylmethyl)-, dimethyl ester
SpectraBase Compound ID 5mOkcPrv915
InChI InChI=1S/C12H18O4/c1-15-11(13)10(12(14)16-2)8-9-6-4-3-5-7-9/h6,10H,3-5,7-8H2,1-2H3
InChIKey DIZOZJWUERIXQP-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AibUwTdEOIW
Name Propanedioic acid, (1-cyclohexen-1-ylmethyl)-, dimethyl ester
CAS Registry Number 60045-25-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-15-11(13)10(12(14)16-2)8-9-6-4-3-5-7-9/h6,10H,3-5,7-8H2,1-2H3
InChIKey DIZOZJWUERIXQP-UHFFFAOYSA-N
Molecular Weight 226.272 g/mol
SMILES C(CC=1CCCCC1)(C(OC)=O)C(OC)=O
SPLASH splash10-002f-9600000000-9e18ece675fb6bb4fa07
Source of Spectrum C-100-3422-0
Synonyms Dimethyl 2-(1-cyclohexen-1-ylmethyl)malonate 2-(1-cyclohexenylmethyl)propanedioic acid dimethyl ester 2-(cyclohexen-1-ylmethyl)malonic acid dimethyl ester Dimethyl 2-(cyclohexen-1-ylmethyl)propanedioate
Wiley ID 1227255