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(1S,2R)-2-butyl-4-[(2R)-2-hydroxypentyl]-5-methylene-1-cyclohex-3-enol
SpectraBase Compound ID 2CCAy72LdpA
InChI InChI=1S/C16H28O2/c1-4-6-8-13-10-14(11-15(17)7-5-2)12(3)9-16(13)18/h10,13,15-18H,3-9,11H2,1-2H3/t13-,15-,16+/m1/s1
InChIKey HWTJMVXVXNNRQC-BMFZPTHFSA-N
Mol Weight 252.4 g/mol
Molecular Formula C16H28O2
Exact Mass 252.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4BnNzMqQXC9
Name (1S,2R)-2-butyl-4-[(2R)-2-hydroxypentyl]-5-methylene-1-cyclohex-3-enol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O2
InChI InChI=1S/C16H28O2/c1-4-6-8-13-10-14(11-15(17)7-5-2)12(3)9-16(13)18/h10,13,15-18H,3-9,11H2,1-2H3/t13-,15-,16+/m1/s1
InChIKey HWTJMVXVXNNRQC-BMFZPTHFSA-N
Molecular Weight 252.398 g/mol
SMILES O[C@]1(CC(C(C[C@](O)(CCC)[H])=C[C@]1(CCCC)[H])=C)[H]
SPLASH splash10-0536-9400000000-de4dc768d2af15581bcc
Source of Spectrum K1-2001-3675-23
Synonyms (1S,2R)-2-butyl-4-[(2R)-2-hydroxypentyl]-5-methylene-cyclohex-3-en-1-ol (1S,2R)-2-butyl-4-[(2R)-2-hydroxypentyl]-5-methylidenecyclohex-3-en-1-ol (1S,2R)-2-butyl-5-methylidene-4-[(2R)-2-oxidanylpentyl]cyclohex-3-en-1-ol
Wiley ID 813521