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(4S,4aR)-4,4a-Dimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one
SpectraBase Compound ID Ew8qu35lKwu
InChI InChI=1S/C12H18O/c1-9-7-11(13)8-10-5-3-4-6-12(9,10)2/h8-9H,3-7H2,1-2H3/t9-,12+/m0/s1
InChIKey NOEZCVRCZNQDGG-JOYOIKCWSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4TByoFhgYi5
Name (4S,4aR)-4,4a-Dimethyl-4,4a,5,6,7,8-hexahydronaphthalen-2(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-9-7-11(13)8-10-5-3-4-6-12(9,10)2/h8-9H,3-7H2,1-2H3/t9-,12+/m0/s1
InChIKey NOEZCVRCZNQDGG-JOYOIKCWSA-N
Molecular Weight 178.275 g/mol
SMILES C1=2[C@]([C@@](C)(CC(C2)=O)[H])(C)CCCC1
SPLASH splash10-0550-2900000000-8885f19a5f1648cd2b47
Source of Spectrum QC-6-1809-14
Wiley ID 868944