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(+)-7,7-Dimethyl-4aS,5,6R,7,8R,8aR-hexahydro-6,8-methano-1H-2-benzopyran-3(4H)-one
SpectraBase Compound ID B55QNcdE3fg
InChI InChI=1S/C12H18O2/c1-12(2)8-3-7-4-11(13)14-6-9(7)10(12)5-8/h7-10H,3-6H2,1-2H3/t7-,8+,9+,10+/m0/s1
InChIKey OOBSVWUDWGWEFP-SGIHWFKDSA-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 349rz5SRB8U
Name 6,8-Methano-3H-2-benzopyran-3-one, octahydro-7,7-dimethyl-, [4aS-(4a.alpha.,6.beta.,8.beta.,8a.alpha.)]-
Alternate Name(s) ((+)-(4aS,6S,8S,8aR)-7,7-dimethyl-6,8-methano-perhydroisochroman-3-one (1R,2R,7S,9R)-10,10-dimethyl-4-oxatricyclo[7.1.1.0(2,7)]undecan-5-one
CAS Registry Number 86833-00-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-12(2)8-3-7-4-11(13)14-6-9(7)10(12)5-8/h7-10H,3-6H2,1-2H3/t7-,8+,9+,10+/m0/s1
InChIKey OOBSVWUDWGWEFP-SGIHWFKDSA-N
Molecular Weight 194.274 g/mol
SMILES [C@@]12(C(C)(C)[C@@](C2)(C[C@@]2([C@]1(COC(=O)C2)[H])[H])[H])[H]
SPLASH splash10-004l-9800000000-7e894df59d00a9fe6fce
Source of Spectrum H-66-1005-0
Wiley ID 1191069