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(5R,6S,7S,10S)-6-Hydroxy-7-isopropyl-10-methylspiro[4.5]decan-2-one
SpectraBase Compound ID F0GPK4aVR6Q
InChI InChI=1S/C14H24O2/c1-9(2)12-5-4-10(3)14(13(12)16)7-6-11(15)8-14/h9-10,12-13,16H,4-8H2,1-3H3/t10-,12-,13-,14+/m0/s1
InChIKey CTADYMGPPJANEN-DOERSZECSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8NAGfImAoT8
Name (5R,6S,7S,10S)-6-Hydroxy-7-isopropyl-10-methylspiro[4.5]decan-2-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.177630011 u
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-9(2)12-5-4-10(3)14(13(12)16)7-6-11(15)8-14/h9-10,12-13,16H,4-8H2,1-3H3/t10-,12-,13-,14+/m0/s1
InChIKey CTADYMGPPJANEN-DOERSZECSA-N
Molecular Weight 224.344 g/mol
SMILES C1C(CC[C@@]11[C@]([C@@](CC[C@@]1(C)[H])(C(C)C)[H])(O)[H])=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.944777