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(4aS,8aR)-1,1,6-trimethyl-4a,7,8,8a-tetrahydro-4H-2-benzopyran-3-one
SpectraBase Compound ID DW9fHU4oyRK
InChI InChI=1S/C12H18O2/c1-8-4-5-10-9(6-8)7-11(13)14-12(10,2)3/h6,9-10H,4-5,7H2,1-3H3/t9-,10-/m1/s1
InChIKey SYXHHJUWTRXMSI-NXEZZACHSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID h0QhE5i8tV
Name (4aS,8aR)-1,1,6-trimethyl-4a,7,8,8a-tetrahydro-4H-2-benzopyran-3-one
CAS Registry Number 107602-66-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-8-4-5-10-9(6-8)7-11(13)14-12(10,2)3/h6,9-10H,4-5,7H2,1-3H3/t9-,10-/m1/s1
InChIKey SYXHHJUWTRXMSI-NXEZZACHSA-N
Molecular Weight 194.274 g/mol
SMILES C1(OC(=O)C[C@@]2([C@]1(CCC(C)=C2)[H])[H])(C)C
SPLASH splash10-0006-9200000000-48194939b97356c29d30
Source of Spectrum H-69-2035-15
Synonyms (4aS,8aR)-1,1,6-trimethyl-4a,7,8,8a-tetrahydro-4H-isochromen-3-one
Wiley ID 1191123