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Phosphoric acid, 1-cyclohexen-1-yl bis(1-methylethyl) ester

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Phosphoric acid, 1-cyclohexen-1-yl bis(1-methylethyl) ester
SpectraBase Compound ID HOuyo8SRpXh
InChI InChI=1S/C12H23O4P/c1-10(2)14-17(13,15-11(3)4)16-12-8-6-5-7-9-12/h8,10-11H,5-7,9H2,1-4H3
InChIKey ASPXPGABXWWYGH-UHFFFAOYSA-N
Mol Weight 262.29 g/mol
Molecular Formula C12H23O4P
Exact Mass 262.133396 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2K3GJ0NMK15
Name Phosphoric acid, 1-cyclohexen-1-yl bis(1-methylethyl) ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 262.133396215 u
Formula C12H23O4P
InChI InChI=1S/C12H23O4P/c1-10(2)14-17(13,15-11(3)4)16-12-8-6-5-7-9-12/h8,10-11H,5-7,9H2,1-4H3
InChIKey ASPXPGABXWWYGH-UHFFFAOYSA-N
Molecular Weight 262.286 g/mol
SMILES C1(OP(=O)(OC(C)C)OC(C)C)=CCCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.900515