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(2R,3R,4R)-5-Chrysanthemen-1,4-diol
SpectraBase Compound ID 8noDmRLiYMQ
InChI InChI=1S/C10H18O2/c1-6(2)9(12)8-7(5-11)10(8,3)4/h7-9,11-12H,1,5H2,2-4H3/t7-,8+,9+/m1/s1
InChIKey JNCMAYULSXIMJC-VGMNWLOBSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CfaunSfHqP7
Name (2R,3R,4R)-5-Chrysanthemen-1,4-diol
Appearance Colorless amorphous solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-6(2)9(12)8-7(5-11)10(8,3)4/h7-9,11-12H,1,5H2,2-4H3/t7-,8+,9+/m1/s1
InChIKey JNCMAYULSXIMJC-VGMNWLOBSA-N
Instrument Name FISONS VG Prospec
Ionization Type EI
Literature Reference DOI 10.1021/np030222l
Molecular Weight 170.252 g/mol
Optical Rotation [a]D25 = -2.0 (c = 0.05, CHCl3)
Reported Formula C10H18O2
SMILES OC[C@@]1([C@@]([C@](C(C)=C)(O)[H])(C1(C)C)[H])[H]
SPLASH splash10-0uki-0900000000-2c9c1c472d11f420f8b6
Source of Spectrum G4-67-40-4
Wiley ID 1881517