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Menthone-spiro-ketal

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

Menthone-spiro-ketal
SpectraBase Compound ID FeJSgTKt5Gu
InChI InChI=1S/C19H36O2/c1-5-6-7-8-9-17-12-13-20-19(21-17)14-16(4)10-11-18(19)15(2)3/h15-18H,5-14H2,1-4H3/t16-,17?,18+,19+/m1/s1
InChIKey YNSUYPKDWKKSQR-DXPBQALJSA-N
Mol Weight 296.5 g/mol
Molecular Formula C19H36O2
Exact Mass 296.27153 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DMk1WKU5HsH
Name Menthone-spiro-ketal
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 296.271530397 u
Formula C19H36O2
InChI InChI=1S/C19H36O2/c1-5-6-7-8-9-17-12-13-20-19(21-17)14-16(4)10-11-18(19)15(2)3/h15-18H,5-14H2,1-4H3/t16-,17?,18+,19+/m1/s1
InChIKey YNSUYPKDWKKSQR-DXPBQALJSA-N
SMILES [C@]12(OC(CCCCCC)CCO2)[C@@](CC[C@](C1)(C)[H])(C(C)C)[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93449