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2(3H)-Benzofuranone, 3a,6,7,7a-tetrahydro-5-methyl-7a-(1-methylethyl)-, (3aS-cis)-
SpectraBase Compound ID Cp0t68XRwE2
InChI InChI=1S/C12H18O2/c1-8(2)12-5-4-9(3)6-10(12)7-11(13)14-12/h6,8,10H,4-5,7H2,1-3H3/t10-,12+/m1/s1
InChIKey JAGANUUWAOWWQA-PWSUYJOCSA-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 4oqh1MzNAW5
Name 2(3H)-Benzofuranone, 3a,6,7,7a-tetrahydro-5-methyl-7a-(1-methylethyl)-, (3aS-cis)-
Alternate Name(s) (3aS,7aS)-7a-isopropyl-5-methyl-3a,6,7,7a-tetrahydro-1-benzofuran-2(3H)-one (3aS,7aS)3a,6,7,7a-tetrahydro-7a-isopropyl-5-mrthyl-1-benzofuran-2(3H)-one (3aS,7aS)-5-methyl-7a-propan-2-yl-3,3a,6,7-tetrahydrobenzofuran-2-one (3aS,7aS)-5-methyl-7a-propan-2-yl-3,3a,6,7-tetrahydro-1-benzofuran-2-one
CAS Registry Number 107602-62-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-8(2)12-5-4-9(3)6-10(12)7-11(13)14-12/h6,8,10H,4-5,7H2,1-3H3/t10-,12+/m1/s1
InChIKey JAGANUUWAOWWQA-PWSUYJOCSA-N
Molecular Weight 194.274 g/mol
SMILES [C@]12([C@](C=C(CC2)C)(CC(O1)=O)[H])C(C)C
SPLASH splash10-0zgi-3900000000-f8cbe4d45ed2c7685636
Source of Spectrum H-69-2035-18
Wiley ID 1191126