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trans-(3R*,8aR*)-3,8a-Dihydro-3-ethyl-8a-methylazulen-1(2H)-one
SpectraBase Compound ID 8DWoihv92fT
InChI InChI=1S/C13H16O/c1-3-10-9-12(14)13(2)8-6-4-5-7-11(10)13/h4-8,10H,3,9H2,1-2H3/t10-,13-/m1/s1
InChIKey OOEBDEVHDSBHRP-ZWNOBZJWSA-N
Mol Weight 188.27 g/mol
Molecular Formula C13H16O
Exact Mass 188.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13bX7tJIhwo
Name trans-(3R*,8aR*)-3,8a-Dihydro-3-ethyl-8a-methylazulen-1(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O
InChI InChI=1S/C13H16O/c1-3-10-9-12(14)13(2)8-6-4-5-7-11(10)13/h4-8,10H,3,9H2,1-2H3/t10-,13-/m1/s1
InChIKey OOEBDEVHDSBHRP-ZWNOBZJWSA-N
Molecular Weight 188.270 g/mol
SMILES [C@@]12(C([C@](CC)(CC2=O)[H])=CC=CC=C1)C
SPLASH splash10-001r-0900000000-7da178a781ddd7329b81
Source of Spectrum KC-0-4086-2
Synonyms (3R,8aR)-3-ethyl-8a-methyl-3,8a-dihydro-1(2H)-azulenone
Wiley ID 827034