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rac- 7,11-Epoxymegastigma-5(6)-en-9-yl acetate

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

rac- 7,11-Epoxymegastigma-5(6)-en-9-yl acetate
SpectraBase Compound ID jPpuv1vDUa
InChI InChI=1S/C15H24O3/c1-10(18-11(2)16)8-13-14-12(9-17-13)6-5-7-15(14,3)4/h10,13H,5-9H2,1-4H3/t10-,13-/m1/s1
InChIKey DKOOPFFIDIFVAS-ZWNOBZJWSA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IRMUHU8u0TB
Name rac- 7,11-Epoxymegastigma-5(6)-en-9-yl acetate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 252.172544630 u
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-10(18-11(2)16)8-13-14-12(9-17-13)6-5-7-15(14,3)4/h10,13H,5-9H2,1-4H3/t10-,13-/m1/s1
InChIKey DKOOPFFIDIFVAS-ZWNOBZJWSA-N
Molecular Weight 252.354 g/mol
SMILES C1=2[C@](OCC2CCCC1(C)C)(C[C@](OC(=O)C)(C)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.867693