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4-Tert-butyl-1-hydroxycyclohexaneacetic acid, tert-butyl ester

View entire compound with spectra: 2 NMR, 2 FTIR, and 1 Raman

4-Tert-butyl-1-hydroxycyclohexaneacetic acid, tert-butyl ester
SpectraBase Compound ID 4xT1ntza5K4
InChI InChI=1S/C16H30O3/c1-14(2,3)12-7-9-16(18,10-8-12)11-13(17)19-15(4,5)6/h12,18H,7-11H2,1-6H3
InChIKey QAOSMVQWHOXGSA-UHFFFAOYSA-N
Mol Weight 270.41 g/mol
Molecular Formula C16H30O3
Exact Mass 270.219495 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID C2lCUcvO8Pa
Name CYCLOHEXANEACETIC ACID, 4-TERT- BUTYL-1-HYDROXY-, TERT-BUTYL ESTER
CAS Registry Number 13278-12-1
Comments 3080
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Detector Name TGS/TRIGLYCINE SULFATE/
Formula C16H30O3
InChI InChI=1S/C16H30O3/c1-14(2,3)12-7-9-16(18,10-8-12)11-13(17)19-15(4,5)6/h12,18H,7-11H2,1-6H3
InChIKey QAOSMVQWHOXGSA-UHFFFAOYSA-N
Instrument Name DIGILAB FTS-14
Melting Point 57C
Molecular Weight 270.42
Technique Vapor Phase