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Santalol acetate<(Z)-beta->
SpectraBase Compound ID 1gfoPDx8eTb
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)6-5-9-17(4)13(2)15-7-8-16(17)10-15/h6,15-16H,2,5,7-11H2,1,3-4H3/b12-6-/t15-,16-,17+/m1/s1
InChIKey RCFGRZLLBGMERD-VHBUNTFRSA-N
Mol Weight 262.39 g/mol
Molecular Formula C17H26O2
Exact Mass 262.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ExMNeHMoMps
Name Santalol acetate <(Z)-, beta->
CAS Registry Number 77-43-0
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 262.193280075 u
Formula C17H26O2
InChI InChI=1S/C17H26O2/c1-12(11-19-14(3)18)6-5-9-17(4)13(2)15-7-8-16(17)10-15/h6,15-16H,2,5,7-11H2,1,3-4H3/b12-6-/t15-,16-,17+/m1/s1
InChIKey RCFGRZLLBGMERD-VHBUNTFRSA-N
Molecular Weight 262.393 g/mol
Number of Peaks 50
RI1 1824
SMILES C1([C@]2(C[C@]([C@]1(CC\C=C/(COC(=O)C)C)C)(CC2)[H])[H])=C
SPLASH splash10-0006-9200000000-845c69057da111c83a02
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Penten-1-ol, 2-methyl-5-[(1S,2R,4R)-2-methyl-3-methylenebicyclo[2.2.1]hept-2-yl]-, acetate, (2Z)-
Wiley ID LM_FFNSC3_2516