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4.beta.,8.alpha.-Dimethyl-4.alpha.,4a.alpha.-tetramethylene-4,4a,5,8-tetrahydro-1(8a.alpha.H)-naphthalenone
SpectraBase Compound ID BLMzgx0Ksyt
InChI InChI=1S/C16H22O/c1-12-6-5-10-16-9-4-3-8-15(16,2)11-7-13(17)14(12)16/h5-7,11-12,14H,3-4,8-10H2,1-2H3/t12-,14-,15-,16-/m0/s1
InChIKey PRZGLKRCHGRUTC-TUUVXOQKSA-N
Mol Weight 230.35 g/mol
Molecular Formula C16H22O
Exact Mass 230.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJUKcYD5mU0
Name 4.beta.,8.alpha.-Dimethyl-4.alpha.,4a.alpha.-tetramethylene-4,4a,5,8-tetrahydro-1(8a.alpha.H)-naphthalenone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22O
InChI InChI=1S/C16H22O/c1-12-6-5-10-16-9-4-3-8-15(16,2)11-7-13(17)14(12)16/h5-7,11-12,14H,3-4,8-10H2,1-2H3/t12-,14-,15-,16-/m0/s1
InChIKey PRZGLKRCHGRUTC-TUUVXOQKSA-N
Molecular Weight 230.351 g/mol
SMILES [C@@]123[C@@](C=CC([C@@]3([C@](C=CC1)(C)[H])[H])=O)(C)CCCC2
SPLASH splash10-0kml-9400000000-bb7ac1f84445a41bcc9f
Source of Spectrum J-56-5356-6
Synonyms (4S,4aR,7aS,11aS)-4,7a-dimethyl-4,4a,8,9,10,11-hexahydro-1H-benzo[d]naphthalen-5(7aH)-one
Wiley ID 1232350