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Trans-cyclononene oxide
SpectraBase Compound ID 2ItZcI5y7Nb
InChI InChI=1S/C9H16O/c1-2-4-6-8-9(10-8)7-5-3-1/h8-9H,1-7H2/t8-,9-/m1/s1
InChIKey REXZYVQYOOPWQD-RKDXNWHRSA-N
Mol Weight 140.23 g/mol
Molecular Formula C9H16O
Exact Mass 140.120115 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LB5SzmUFhlp
Name Trans-cyclononene oxide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 140.120115134 u
Formula C9H16O
InChI InChI=1S/C9H16O/c1-2-4-6-8-9(10-8)7-5-3-1/h8-9H,1-7H2/t8-,9-/m1/s1
InChIKey REXZYVQYOOPWQD-RKDXNWHRSA-N
Molecular Weight 140.226 g/mol
SMILES [C@@]12(O[C@@]1(CCCCCCC2)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.909629