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(2a.alpha.,2b.alpha.,3.beta.,6.beta.,6a.alpha.,6b.alpha.)-2a,2b,3,6,6a,6b-Hexahydro-2-methyl-3,6-epoxycycloprop[cd]azulene

View entire compound with spectra: 1 MS (GC)

(2a.alpha.,2b.alpha.,3.beta.,6.beta.,6a.alpha.,6b.alpha.)-2a,2b,3,6,6a,6b-Hexahydro-2-methyl-3,6-epoxycycloprop[cd]azulene
SpectraBase Compound ID Hub8LY9lymk
InChI InChI=1S/C11H12O/c1-5-4-6-7-2-3-8(12-7)11-9(5)10(6)11/h2-4,6-11H,1H3/t6-,7-,8+,9-,10+,11-/m1/s1
InChIKey LDDXLQCIJZPWJY-QHAQEBJBSA-N
Mol Weight 160.22 g/mol
Molecular Formula C11H12O
Exact Mass 160.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BhGCYNv8sc2
Name (2a.alpha.,2b.alpha.,3.beta.,6.beta.,6a.alpha.,6b.alpha.)-2a,2b,3,6,6a,6b-Hexahydro-2-methyl-3,6-epoxycycloprop[cd]azulene
Alternate Name(s) (1S,2S,4R,7R,8R)-5-methyl-11-oxatetracyclo[6.2.1.0(2,4).0(3,7)]undeca-5,9-diene
CAS Registry Number 55165-02-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O
InChI InChI=1S/C11H12O/c1-5-4-6-7-2-3-8(12-7)11-9(5)10(6)11/h2-4,6-11H,1H3/t6-,7-,8+,9-,10+,11-/m1/s1
InChIKey LDDXLQCIJZPWJY-QHAQEBJBSA-N
Molecular Weight 160.216 g/mol
SMILES [C@@]12([C@@]3([C@]([C@@]4(O[C@]([C@]23[H])(C=C4)[H])[H])([H])C=C1C)[H])[H]
SPLASH splash10-0006-9200000000-df6739ec1cea98e10d46
Source of Spectrum J-46-2678-0
Wiley ID 1157173