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3,5,7a-trimethyl-3,3a,6,7a-tetrahydro-3,6-methanobenzofuran-7(2H)-one
SpectraBase Compound ID AtRwistm9eq
InChI InChI=1S/C12H16O2/c1-7-4-9-11(2)5-8(7)10(13)12(9,3)14-6-11/h4,8-9H,5-6H2,1-3H3/t8-,9-,11-,12+/m1/s1
InChIKey VEKVCRXVEBPRQS-IQIPOGNMSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nW6ke5ukIk
Name 3,5,7a-trimethyl-3,3a,6,7a-tetrahydro-3,6-methanobenzofuran-7(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-7-4-9-11(2)5-8(7)10(13)12(9,3)14-6-11/h4,8-9H,5-6H2,1-3H3/t8-,9-,11-,12+/m1/s1
InChIKey VEKVCRXVEBPRQS-IQIPOGNMSA-N
Literature Reference DOI 10.1021/ol7028178
Molecular Weight 192.258 g/mol
SMILES [C@@]12(OC[C@@]3([C@]1(C=C([C@](C2=O)(C3)[H])C)[H])C)C
SPLASH splash10-05mk-0900000000-4963971cf8ca52b147a4
Source of Spectrum A1-10-449/SMS4-7
Wiley ID 1759012