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Trogopteroid A
SpectraBase Compound ID 7ZSajOmwrIq
InChI InChI=1S/C18H22O3/c1-11-12-4-9-18-10-16(2,15(20)21-18)7-6-14(18)17(12,3)8-5-13(11)19/h4,9,14H,5-8,10H2,1-3H3/t14?,16-,17-,18-/m0/s1
InChIKey IDZFHPGGTPUPGD-ZWBPCXSVSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 346mpzHS26f
Name Trogopteroid A
Appearance White gum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-11-12-4-9-18-10-16(2,15(20)21-18)7-6-14(18)17(12,3)8-5-13(11)19/h4,9,14H,5-8,10H2,1-3H3/t14?,16-,17-,18-/m0/s1
InChIKey IDZFHPGGTPUPGD-ZWBPCXSVSA-N
Instrument Name Finnigan-4510
Ionization Type EI
Literature Reference DOI 10.1021/np900814s
Molecular Weight 286.371 g/mol
Optical Rotation [a]D24 = +179.2 (c = 0.39, MeOH)
Reported Formula C18H23O3
SMILES C1C[C@]2(C(=C(C1=O)C)C=C[C@]13C2CC[C@@](C3)(C(O1)=O)C)C
SPLASH splash10-05bu-0790000000-5b4f0fbc42ef92c66339
Source of Spectrum G4-73-868-1
Wiley ID 1846443