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1-Ethylcyclohexanecarboxylic acid

View entire compound with spectra: 3 MS (GC)

1-Ethylcyclohexanecarboxylic acid
SpectraBase Compound ID 7Llsl89M5LZ
InChI InChI=1S/C9H16O2/c1-2-9(8(10)11)6-4-3-5-7-9/h2-7H2,1H3,(H,10,11)
InChIKey QRRSHRVKVLSFQS-UHFFFAOYSA-N
Mol Weight 156.22 g/mol
Molecular Formula C9H16O2
Exact Mass 156.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Sp827Ueqku
Name 1-Ethylcyclohexanecarboxylic acid
Alternate Name(s) 1-Ethyl-1-cyclohexanecarboxylic acid 1-Ethylcyclohexane-1-carboxylic acid Cyclohexanecarboxylic acid, 1-ethyl-
CAS Registry Number 97387-05-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O2
InChI InChI=1S/C9H16O2/c1-2-9(8(10)11)6-4-3-5-7-9/h2-7H2,1H3,(H,10,11)
InChIKey QRRSHRVKVLSFQS-UHFFFAOYSA-N
Molecular Weight 156.225 g/mol
SMILES OC(C1(CCCCC1)CC)=O
SPLASH splash10-0n29-9500000000-364d8d54e84428722102
Wiley ID 1491266