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1-[(1R,3S)-1-Methyl-3-(1-methylethenyl)cyclopent-1-yl][2-2H]propan-1-one
SpectraBase Compound ID HYWCTPToqVY
InChI InChI=1S/C12H20O/c1-5-11(13)12(4)7-6-10(8-12)9(2)3/h10H,2,5-8H2,1,3-4H3/t10-,12+/m0/s1/i5D/t5?,10-,12+
InChIKey RNDCOVAWPJIXBA-RYQODGTNSA-N
Mol Weight 181.3 g/mol
Molecular Formula C12H192DO
Exact Mass 181.157692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 987ufwEDagO
Name 1-[(1R,3S)-1-Methyl-3-(1-methylethenyl)cyclopent-1-yl][2-2H]propan-1-one
Alternate Name(s) 1-((1R,3S)-1-methyl-3-(prop-1-en-2-yl)cyclopentyl)propan-1-one-2-D
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19DO
InChI InChI=1S/C12H20O/c1-5-11(13)12(4)7-6-10(8-12)9(2)3/h10H,2,5-8H2,1,3-4H3/t10-,12+/m0/s1/i5D/t5?,10-,12+
InChIKey RNDCOVAWPJIXBA-RYQODGTNSA-N
Literature Reference DOI 10.1002/hlca.200490180
Molecular Weight 181.297 g/mol
SMILES C[C@]1(CC[C@](C(C)=C)(C1)[H])C(C(C)[2D])=O
SPLASH splash10-05ai-9300000000-1e6e25e82d40417ceb8a
Source of Spectrum H-87-2017-[(2)H]_8
Wiley ID 1785580