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4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol, me

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

4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol, me
SpectraBase Compound ID bFl6vVLBQF
InChI InChI=1S/C16H28O3/c1-10(2)11-6-8-15(3)12(18-15)7-9-16(4)14(19-16)13(11)17-5/h10-14H,6-9H2,1-5H3
InChIKey BUMLOUDYIVHQKB-UHFFFAOYSA-N
Mol Weight 268.4 g/mol
Molecular Formula C16H28O3
Exact Mass 268.203845 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID D2QRwt8dMnl
Name 4,11-Dimethyl-8-(propan-2-yl)-5,12-dioxatricyclo[9.1.0.04,6]dodecan-7-ol, me
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.203844759 u
Formula C16H28O3
InChI InChI=1S/C16H28O3/c1-10(2)11-6-8-15(3)12(18-15)7-9-16(4)14(19-16)13(11)17-5/h10-14H,6-9H2,1-5H3
InChIKey BUMLOUDYIVHQKB-UHFFFAOYSA-N
SMILES C12CCC3(OC3C(C(CCC1(O2)C)C(C)C)OC)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.929748