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1-(Adamantyl-1)hexen-6-ol-1
SpectraBase Compound ID 1Dd5Zby43mP
InChI InChI=1S/C16H26O/c17-6-4-2-1-3-5-16-10-13-7-14(11-16)9-15(8-13)12-16/h3,5,13-15,17H,1-2,4,6-12H2/b5-3+/t13-,14+,15-,16+
InChIKey MOHBOXHUQWLOED-LMCUDZPJSA-N
Mol Weight 234.38 g/mol
Molecular Formula C16H26O
Exact Mass 234.198365 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Ll5pDgisCBA
Name 1-(Adamantyl-1)hexen-6-ol-1
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.198365456 u
Formula C16H26O
InChI InChI=1S/C16H26O/c17-6-4-2-1-3-5-16-10-13-7-14(11-16)9-15(8-13)12-16/h3,5,13-15,17H,1-2,4,6-12H2/b5-3+/t13-,14+,15-,16+
InChIKey MOHBOXHUQWLOED-LMCUDZPJSA-N
Molecular Weight 234.383 g/mol
SMILES C(O)CCC\C=C\C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.892741