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Cabreuva oxide B
SpectraBase Compound ID IJajoJVbGgG
InChI InChI=1S/C15H24O/c1-6-15(5)10-12-9-11(2)7-8-13(12)14(3,4)16-15/h6,9,12-13H,1,7-8,10H2,2-5H3/t12-,13-,15-/m1/s1
InChIKey NIGRJVWIKNICMW-UMVBOHGHSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BGoa5lAWSH8
Name (3S,4aS,8aR)-1,1,3,6-tetramethyl-3-vinyl-4a,7,8,8a-tetrahydro-4H-isochromene
CAS Registry Number 107602-53-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O
InChI InChI=1S/C15H24O/c1-6-15(5)10-12-9-11(2)7-8-13(12)14(3,4)16-15/h6,9,12-13H,1,7-8,10H2,2-5H3/t12-,13-,15-/m1/s1
InChIKey NIGRJVWIKNICMW-UMVBOHGHSA-N
Molecular Weight 220.356 g/mol
SMILES C1(O[C@@](C=C)(C)C[C@@]2([C@]1(CCC(C)=C2)[H])[H])(C)C
SPLASH splash10-0006-9100000000-e9768b8a227789ce403a
Source of Spectrum H-69-2037-2
Synonyms (3S,4aS,8aR)-3-ethenyl-1,1,3,6-tetramethyl-4a,7,8,8a-tetrahydro-4H-2-benzopyran (3S,4aS,8aR)-3-ethenyl-1,1,3,6-tetramethyl-4a,7,8,8a-tetrahydro-4H-isochromene
Wiley ID 1220754