For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

12-Hydroxy-dehydro-Botrydienol

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

12-Hydroxy-dehydro-Botrydienol
SpectraBase Compound ID GfJHAw2M1wz
InChI InChI=1S/C15H22O3/c1-10-4-5-12-13(11(10)6-16)15(3,9-18)7-14(12,2)8-17/h4-5,16-18H,6-9H2,1-3H3/t14-,15+/m0/s1
InChIKey YPJRKTIWVUVMDI-LSDHHAIUSA-N
Mol Weight 250.34 g/mol
Molecular Formula C15H22O3
Exact Mass 250.156895 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 7fIDdZTDfzn
Name 12-Hydroxydehydrobotrydienol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.156894565 u
Formula C15H22O3
InChI InChI=1S/C15H22O3/c1-10-4-5-12-13(11(10)6-16)15(3,9-18)7-14(12,2)8-17/h4-5,16-18H,6-9H2,1-3H3/t14-,15+/m0/s1
InChIKey YPJRKTIWVUVMDI-LSDHHAIUSA-N
Molecular Weight 250.338 g/mol
SMILES C(O)C1=C(C)C=CC=2[C@](C)(CO)C[C@@](C12)(CO)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.888789