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2H-Cyclopropa[b]naphthalen-2-one, 1,1a,2a,3,6,6a,7,7a-octahydro-1,1,2a,4,5-pentamethyl-, [1aS-(1a.alpha.,2a.beta.,6a.beta.,7a.alpha.)]-
SpectraBase Compound ID CZaQPUgUVMF
InChI InChI=1S/C16H24O/c1-9-6-11-7-12-13(15(12,3)4)14(17)16(11,5)8-10(9)2/h11-13H,6-8H2,1-5H3/t11-,12-,13-,16-/m0/s1
InChIKey XLJMFPSCFKXYOE-QCQGSNGOSA-N
Mol Weight 232.37 g/mol
Molecular Formula C16H24O
Exact Mass 232.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4U2ML1ZfsaO
Name 2H-Cyclopropa[b]naphthalen-2-one, 1,1a,2a,3,6,6a,7,7a-octahydro-1,1,2a,4,5-pentamethyl-, [1aS-(1a.alpha.,2a.beta.,6a.beta.,7a.alpha.)]-
CAS Registry Number 127279-91-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O
InChI InChI=1S/C16H24O/c1-9-6-11-7-12-13(15(12,3)4)14(17)16(11,5)8-10(9)2/h11-13H,6-8H2,1-5H3/t11-,12-,13-,16-/m0/s1
InChIKey XLJMFPSCFKXYOE-QCQGSNGOSA-N
Molecular Weight 232.367 g/mol
SMILES [C@]12(C(C)(C)[C@]2(C[C@]2([C@@](C1=O)(CC(C)=C(C2)C)C)[H])[H])[H]
SPLASH splash10-0pbc-2900000000-47625004707b154ae530
Source of Spectrum J-55-4263-4
Synonyms (1aR,2aS,6aR,7aS)-1,1,2a,4,5-pentamethyl-1,1a,2a,3,6,6a,7,7a-octahydro-2H-cyclopropa[b]naphthalen-2-one
Wiley ID 1234426