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(1S,2S,5S)-2-hydroxy-3-pinone
SpectraBase Compound ID EgKQfHkvcHt
InChI InChI=1S/C10H16O2/c1-9(2)6-4-7(9)10(3,12)8(11)5-6/h6-7,12H,4-5H2,1-3H3/t6-,7-,10-/m0/s1
InChIKey VZRRCQOUNSHSGB-BYULHYEWSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UhxVVyhY9C
Name (1S,2S,5S)-2-hydroxy-3-pinone
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-9(2)6-4-7(9)10(3,12)8(11)5-6/h6-7,12H,4-5H2,1-3H3/t6-,7-,10-/m0/s1
InChIKey VZRRCQOUNSHSGB-BYULHYEWSA-N
Ionization Type EI
Molecular Weight 168.236 g/mol
Optical Rotation [a]D25 = +37.5 (c = 0.5, CHCl3)
SMILES O[C@@]1(C)[C@]2(C[C@@](CC1=O)(C2(C)C)[H])[H]
SPLASH splash10-006t-9000000000-e764c7bb09927ed82d90
Source of Spectrum CN102826983A
Wiley ID 1846623