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AAMGTTAZIKVMCG-CVNLYIMZSA-N
SpectraBase Compound ID XPTzzLLaCC
InChI InChI=1S/C23H30O6/c1-13(2)23(27)9-8-22(4)19(25)11-14(3)10-18(20(22)23)29-21(26)15-6-7-16(24)17(12-15)28-5/h6-7,11-13,18,20,24,27H,8-10H2,1-5H3/t18-,20+,22+,23+/m0/s1
InChIKey AAMGTTAZIKVMCG-CVNLYIMZSA-N
Mol Weight 402.49 g/mol
Molecular Formula C23H30O6
Exact Mass 402.204239 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMxRLlAONde
Name 5-[(Vanilloyl)oxy]-3,7-dimethyl-8-hydroxy-8-isopropylbicyclo[5.3.0]dec-2-en-1-onee
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O6
InChI InChI=1S/C23H30O6/c1-13(2)23(27)9-8-22(4)19(25)11-14(3)10-18(20(22)23)29-21(26)15-6-7-16(24)17(12-15)28-5/h6-7,11-13,18,20,24,27H,8-10H2,1-5H3/t18-,20+,22+,23+/m0/s1
InChIKey AAMGTTAZIKVMCG-CVNLYIMZSA-N
Molecular Weight 402.487 g/mol
SMILES Oc1c(cc(C(O[C@]2(CC(=CC([C@@]3([C@@]2([C@@](CC3)(C(C)C)O)[H])C)=O)C)[H])=O)cc1)OC
SPLASH splash10-014u-0940000000-197766d549b31105ee84
Source of Spectrum X2-51-1144-6
Wiley ID 1602916