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(2S,3S)-2-butyl-3-methyl-1-cyclobutanone
SpectraBase Compound ID 4Et0c3xoSUO
InChI InChI=1S/C9H16O/c1-3-4-5-8-7(2)6-9(8)10/h7-8H,3-6H2,1-2H3/t7-,8-/m0/s1
InChIKey DACKNCRSLNMTOP-YUMQZZPRSA-N
Mol Weight 140.23 g/mol
Molecular Formula C9H16O
Exact Mass 140.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ew5btwssVSl
Name (2S,3S)-2-butyl-3-methyl-1-cyclobutanone
Alternate Name(s) (2S,3S)-2-butyl-3-methyl-cyclobutan-1-one (2S,3S)-2-butyl-3-methyl-cyclobutanone
CAS Registry Number 118744-04-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O
InChI InChI=1S/C9H16O/c1-3-4-5-8-7(2)6-9(8)10/h7-8H,3-6H2,1-2H3/t7-,8-/m0/s1
InChIKey DACKNCRSLNMTOP-YUMQZZPRSA-N
Molecular Weight 140.226 g/mol
SMILES C1(C[C@@]([C@@]1(CCCC)[H])(C)[H])=O
SPLASH splash10-0a4i-9000000000-e3a1df2942e2b83a6f11
Source of Spectrum F-45-3160-26
Wiley ID 1139760