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(cis)-Sobreryl diacetate

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

(cis)-Sobreryl diacetate
SpectraBase Compound ID DZMXbqOdaD2
InChI InChI=1S/C14H22O4/c1-4-13(15)17-9-11-7-6-10(3)12(8-11)18-14(16)5-2/h6,11-12H,4-5,7-9H2,1-3H3/t11-,12-/m0/s1
InChIKey VEGYCZMRXLDTNK-RYUDHWBXSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2SsLw5XCwgo
Name (cis)-Sobreryl diacetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 254.151809184 u
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-4-13(15)17-9-11-7-6-10(3)12(8-11)18-14(16)5-2/h6,11-12H,4-5,7-9H2,1-3H3/t11-,12-/m0/s1
InChIKey VEGYCZMRXLDTNK-RYUDHWBXSA-N
Molecular Weight 254.326 g/mol
SMILES [C@@]1(C(=CC[C@@](C1)(COC(=O)CC)[H])C)(OC(=O)CC)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.958129