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Dichomitin A
SpectraBase Compound ID LZtKeHZLUK1
InChI InChI=1S/C15H24O3/c1-14(8-17)5-10-11(6-14)15(2)4-3-9(7-16)12(15)13(10)18/h10-11,13,16-18H,3-8H2,1-2H3/t10-,11+,13+,14+,15-/m0/s1
InChIKey RTRNIJJMGPYEML-JHOKLZQASA-N
Mol Weight 252.35 g/mol
Molecular Formula C15H24O3
Exact Mass 252.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EoPyIDGAg8C
Name Dichomitin A
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O3
InChI InChI=1S/C15H24O3/c1-14(8-17)5-10-11(6-14)15(2)4-3-9(7-16)12(15)13(10)18/h10-11,13,16-18H,3-8H2,1-2H3/t10-,11+,13+,14+,15-/m0/s1
InChIKey RTRNIJJMGPYEML-JHOKLZQASA-N
Instrument Name Micromass platform 200
Ionization Type EI
Literature Reference DOI 10.1021/np0497144
Molecular Weight 252.354 g/mol
Optical Rotation [a]D20 = +6.3 (c = 0.168, MeOH)
Reported Formula C15H24O3
SMILES OC[C@@]1(C[C@@]2([C@](C3=C(CO)CC[C@]3([C@@]2(C1)[H])C)(O)[H])[H])C
SPLASH splash10-0a6r-9210000000-87599d764ff3d1b23f9b
Source of Spectrum G4-67-2123-1
Wiley ID 1881629