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WGGGLYPWFRDVEK-HPTDNVDKSA-N
SpectraBase Compound ID GW7M4QS97kE
InChI InChI=1S/C14H22O2/c1-13(2)9-4-5-10(15)8-6-7-14(3,16)11(8)12(9)13/h8-9,11-12,16H,4-7H2,1-3H3/t8-,9+,11+,12+,14-/m1/s1
InChIKey WGGGLYPWFRDVEK-HPTDNVDKSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5B98SRP5UW
Name (1aS,4aS,7R,7aR,7bS)-1,1,7-trimethyl-7-oxidanyl-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[e]azulen-4-one
CAS Registry Number 77399-46-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-13(2)9-4-5-10(15)8-6-7-14(3,16)11(8)12(9)13/h8-9,11-12,16H,4-7H2,1-3H3/t8-,9+,11+,12+,14-/m1/s1
InChIKey WGGGLYPWFRDVEK-HPTDNVDKSA-N
Molecular Weight 222.328 g/mol
SMILES O[C@]1([C@@]2([C@]3(C(C)(C)[C@]3(CCC([C@]2(CC1)[H])=O)[H])[H])[H])C
SPLASH splash10-08n9-5960000000-7355acd12ad353839cdc
Source of Spectrum K-114-129-0
Synonyms (1aS,4aS,7R,7aR,7bS)-7-hydroxy-1,1,7-trimethyl-1a,2,3,4a,5,6,7a,7b-octahydrocyclopropa[e]azulen-4-one (1aS,4aS,7R,7aR,7bS)-7-hydroxy-1,1,7-trimethyl-1a,2,3,4a,5,6,7a,7b-octahydrocycloprop[e]azulen-4-one
Wiley ID 1222862