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(3S,6S,7S)-1,10-bisaboladien-3-ol
SpectraBase Compound ID I2deRBvCJVV
InChI InChI=1S/C15H26O/c1-12(2)6-5-7-13(3)14-8-10-15(4,16)11-9-14/h6,8,10,13-14,16H,5,7,9,11H2,1-4H3/t13-,14-,15+/m0/s1
InChIKey VVCHIOKYQRUBED-SOUVJXGZSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5C4rHzTQb3
Name (3S,6S,7S)-1,10-bisaboladien-3-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O
InChI InChI=1S/C15H26O/c1-12(2)6-5-7-13(3)14-8-10-15(4,16)11-9-14/h6,8,10,13-14,16H,5,7,9,11H2,1-4H3/t13-,14-,15+/m0/s1
InChIKey VVCHIOKYQRUBED-SOUVJXGZSA-N
Instrument Name Agilent Technologies 5973-6890 N
Ionization Type EI
Molecular Weight 222.372 g/mol
Optical Rotation [a]D20 = +14.2 (c = 1.1, DCM)
Reported Formula C15H26O
SMILES O[C@]1(CC[C@](C=C1)([C@](CCC=C(C)C)(C)[H])[H])C
SPLASH splash10-014l-9510000000-6d6c959e0a36fcd5532f
Source of Spectrum US20140161764A1
Wiley ID 1852526