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4,2,7-Ethanylylidenecyclopenta[b]pyran-9-ol, 2,3,4,4a,7,7a-hexahydro-7a-methyl-, (2.alpha.,4.alpha.,4a.beta.,7.alpha.,7a.beta.,9S*)-
SpectraBase Compound ID 9Ljgg0dGjVf
InChI InChI=1S/C11H14O2/c1-11-6-2-3-7(11)9-8(13-11)4-5(6)10(9)12/h2-3,5-10,12H,4H2,1H3/t5-,6-,7+,8-,9-,10+,11+/m1/s1
InChIKey GAQRCYZPXDLLRU-VCUYNBBDSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4dgkyCBdPzb
Name 4,2,7-Ethanylylidenecyclopenta[B]pyran-9-ol, 2,3,4,4A,7,7A-hexahydro-7A-methyl-, (2.alpha.,4.alpha.,4A.beta.,7.alpha.,7A.beta.,9S*)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 178.099379689 u
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-11-6-2-3-7(11)9-8(13-11)4-5(6)10(9)12/h2-3,5-10,12H,4H2,1H3/t5-,6-,7+,8-,9-,10+,11+/m1/s1
InChIKey GAQRCYZPXDLLRU-VCUYNBBDSA-N
Molecular Weight 178.231 g/mol
SMILES C1[C@@]2([C@@]3([C@]([C@]1([C@]1(C=C[C@@]3([C@]1(O2)C)[H])[H])[H])(O)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.979209