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4a.beta.-methyl-1,1a.beta.,2,3,4,4a-hexahydro-5(8H)-cyclopropa[d]naphthalenone
SpectraBase Compound ID IUKFe1nANhe
InChI InChI=1S/C12H16O/c1-11-6-2-4-9-8-12(9,11)7-3-5-10(11)13/h3,7,9H,2,4-6,8H2,1H3/t9?,11-,12?/m1/s1
InChIKey OYSAUQPBJDLCAJ-CKBZRRDASA-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 7jMUHJqijin
Name 4a.beta.-methyl-1,1a.beta.,2,3,4,4a-hexahydro-5(8H)-cyclopropa[d]naphthalenone
Alternate Name(s) (4aS)-4a-methyl-1,1a,2,3,4,4a-hexahydrocyclopropa[d]naphthalen-5(6H)-one
CAS Registry Number 93861-07-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-11-6-2-4-9-8-12(9,11)7-3-5-10(11)13/h3,7,9H,2,4-6,8H2,1H3/t9?,11-,12?/m1/s1
InChIKey OYSAUQPBJDLCAJ-CKBZRRDASA-N
Molecular Weight 176.259 g/mol
SMILES C123[C@@](C(=O)CC=C3)(CCCC1C2)C
SPLASH splash10-0571-9400000000-a146269c4c2e9a5c3156
Source of Spectrum J-50-263-57
Wiley ID 1172755