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(2S,8R)-8-hydroxy-2-[(1S)-1-hydroxyheptyl]-2,3,4,6,7,8-hexahydro-1-benzopyran-5-one
SpectraBase Compound ID KBmkrDSvjkv
InChI InChI=1S/C16H26O4/c1-2-3-4-5-6-13(18)15-10-7-11-12(17)8-9-14(19)16(11)20-15/h13-15,18-19H,2-10H2,1H3/t13-,14+,15-/m0/s1
InChIKey INHVGPIPHZJQOP-ZNMIVQPWSA-N
Mol Weight 282.38 g/mol
Molecular Formula C16H26O4
Exact Mass 282.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RCq2u9DDFB
Name (2S,8R)-8-hydroxy-2-[(1S)-1-hydroxyheptyl]-2,3,4,6,7,8-hexahydro-1-benzopyran-5-one
Alternate Name(s) (2S,8R)-8-hydroxy-2-[(1S)-1-hydroxyheptyl]-2,3,4,6,7,8-hexahydrochromen-5-one (2S,8R)-8-oxidanyl-2-[(1S)-1-oxidanylheptyl]-2,3,4,6,7,8-hexahydrochromen-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O4
InChI InChI=1S/C16H26O4/c1-2-3-4-5-6-13(18)15-10-7-11-12(17)8-9-14(19)16(11)20-15/h13-15,18-19H,2-10H2,1H3/t13-,14+,15-/m0/s1
InChIKey INHVGPIPHZJQOP-ZNMIVQPWSA-N
Molecular Weight 282.380 g/mol
SMILES O[C@@]1(CCC(C2=C1O[C@]([C@@](O)(CCCCCC)[H])(CC2)[H])=O)[H]
SPLASH splash10-0udi-2940000000-cb5abdfaeeddd10d8e51
Source of Spectrum SO-0-126-31
Wiley ID 864035