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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fya8FyLkvgW
Name 12-Hydroxy-dehydro-Botrydienol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
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 OCc1c(ccc2c1[C@@](CO)(C[C@]2(CO)C)C)C
SPLASH splash10-0f89-0970000000-a8760776383c81ecf1eb
Source of Spectrum G4-63-184-7
Synonyms [(1R,3S)-1,3-bis(hydroxymethyl)-1,3,5-trimethyl-indan-4-yl]methanol [(1R,3S)-1,3-bis(hydroxymethyl)-1,3,5-trimethyl-2H-inden-4-yl]methanol
Wiley ID 1608211