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(4Z,3S,8R,11S)-Caryophyll-4(5)-ene-3,8,14-triol - 3,14-Diacetate
SpectraBase Compound ID 4rygNu8tfAm
InChI InChI=1S/C19H30O5/c1-12-7-6-8-19(5,22)16-10-18(4,11-23-13(2)20)15(16)9-17(12)24-14(3)21/h7,15-17,22H,6,8-11H2,1-5H3/b12-7-/t15?,16?,17-,18+,19+/m0/s1
InChIKey YUEWZTJQZKAHQA-FZEYPNESSA-N
Mol Weight 338.44 g/mol
Molecular Formula C19H30O5
Exact Mass 338.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ded5JhSfZ1Z
Name (4Z,3S,8R,11S)-Caryophyll-4(5)-ene-3,8,14-triol - 3,14-Diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30O5
InChI InChI=1S/C19H30O5/c1-12-7-6-8-19(5,22)16-10-18(4,11-23-13(2)20)15(16)9-17(12)24-14(3)21/h7,15-17,22H,6,8-11H2,1-5H3/b12-7-/t15?,16?,17-,18+,19+/m0/s1
InChIKey YUEWZTJQZKAHQA-FZEYPNESSA-N
Molecular Weight 338.444 g/mol
SMILES O[C@]1(C2C([C@](COC(=O)C)(C)C2)C[C@@](\C(=C/CC1)C)(OC(=O)C)[H])C
SPLASH splash10-008a-9320000000-e68346ee62c9dc5f917a
Source of Spectrum G4-63-47-0
Wiley ID 1608186