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(4aR,8aR)-3,5,8a-trimethyl-4a,7,8,9-tetrahydro-4H-benzo[f][1]benzoxole
SpectraBase Compound ID Lut1o0sP5qY
InChI InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h5,9,13H,4,6-8H2,1-3H3/t13-,15+/m0/s1
InChIKey PPKYWUUCDHWAPN-DZGCQCFKSA-N
Mol Weight 216.32 g/mol
Molecular Formula C15H20O
Exact Mass 216.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8EIJPxDdcBl
Name (4aR,8aR)-3,5,8a-trimethyl-4a,7,8,9-tetrahydro-4H-benzo[f]benzofuran
Appearance Amorphous powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O
InChI InChI=1S/C15H20O/c1-10-5-4-6-15(3)8-14-12(7-13(10)15)11(2)9-16-14/h5,9,13H,4,6-8H2,1-3H3/t13-,15+/m0/s1
InChIKey PPKYWUUCDHWAPN-DZGCQCFKSA-N
Instrument Name TRIO 2000 VG Carlo Erba
Ionization Type EI
Literature Reference DOI 10.1021/np030201r
Molecular Weight 216.324 g/mol
Optical Rotation [a]D = 70.2 (c = 0.5, n-hexane)
SMILES C1C[C@]2([C@](C(=C1)C)(Cc1c(C2)occ1C)[H])C
SPLASH splash10-066r-1690000000-2d98c9d70d6f30fb048a
Source of Spectrum G4-66-1518-2
Wiley ID 1883909