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Anti-3-methyl-5-methylenenon-2-en-4-ol

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

Anti-3-methyl-5-methylenenon-2-en-4-ol
SpectraBase Compound ID 12TlsUAN4tz
InChI InChI=1S/C11H20O/c1-5-7-8-10(4)11(12)9(3)6-2/h6,9,11-12H,2,4-5,7-8H2,1,3H3/t9-,11-/m0/s1
InChIKey RGQMLFAQPBBGLP-ONGXEEELSA-N
Mol Weight 168.28 g/mol
Molecular Formula C11H20O
Exact Mass 168.151415 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID I2twfwtVzaT
Name Anti-3-methyl-5-methylenenon-2-en-4-ol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 168.151415263 u
Formula C11H20O
InChI InChI=1S/C11H20O/c1-5-7-8-10(4)11(12)9(3)6-2/h6,9,11-12H,2,4-5,7-8H2,1,3H3/t9-,11-/m0/s1
InChIKey RGQMLFAQPBBGLP-ONGXEEELSA-N
Molecular Weight 168.280 g/mol
SMILES C([C@]([C@](C=C)(C)[H])(O)[H])(=C)CCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.849731