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(1R*,5R*,6R*)-6-Methyltricyclo[3.3.3.0]undec-3-en-2-one
SpectraBase Compound ID GRQVLQF2Cfy
InChI InChI=1S/C12H16O/c1-9-3-7-12-6-2-5-11(9,12)8-4-10(12)13/h4,8-9H,2-3,5-7H2,1H3/t9-,11+,12+/m1/s1
InChIKey YEZUFAIPZUFVER-USWWRNFRSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Umf0XsEoEN
Name (1R*,5R*,6R*)-6-Methyltricyclo[3.3.3.0]undec-3-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-9-3-7-12-6-2-5-11(9,12)8-4-10(12)13/h4,8-9H,2-3,5-7H2,1H3/t9-,11+,12+/m1/s1
InChIKey YEZUFAIPZUFVER-USWWRNFRSA-N
Literature Reference DOI 10.1002/hlca.19810640417
Molecular Weight 176.259 g/mol
SMILES C1(C=C[C@]23[C@@](CC[C@@]13CCC2)(C)[H])=O
SPLASH splash10-005c-3900000000-3c63358f3f9bcc267a0b
Source of Spectrum H-64-1130-4
Synonyms (3aR,4R,6aR)-4-methyl-5,6-dihydro-1H,4H-3a,6a-propanopentalen-1-one
Wiley ID 1797576