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1-Cyclopentene-1-carboxaldehyde, 5-[2-(acetyloxy)-1-methylethyl]-2-methyl-, [S-(R*,S*)]-
SpectraBase Compound ID ItZdcfn24qf
InChI InChI=1S/C12H18O3/c1-8-4-5-11(12(8)6-13)9(2)7-15-10(3)14/h6,9,11H,4-5,7H2,1-3H3/t9?,11-/m0/s1
InChIKey IXMHAPIKHBCMRL-UMJHXOGRSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4FUcz4nRG4
Name 1-Cyclopentene-1-carboxaldehyde, 5-[2-(acetyloxy)-1-methylethyl]-2-methyl-, [S-(R*,S*)]-
CAS Registry Number 77614-35-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c1-8-4-5-11(12(8)6-13)9(2)7-15-10(3)14/h6,9,11H,4-5,7H2,1-3H3/t9?,11-/m0/s1
InChIKey IXMHAPIKHBCMRL-UMJHXOGRSA-N
Molecular Weight 210.273 g/mol
SMILES C=1([C@@](CCC1C)(C(COC(=O)C)C)[H])C=O
SPLASH splash10-0pc3-8900000000-a89789e056b85da407a9
Source of Spectrum F-36-3117-0
Synonyms (2S)-2-[(1S)-2-formyl-3-methyl-2-cyclopenten-1-yl]propyl acetate (3R,8S)-1-methyl-2-formyl-3(.beta.-acetoxy-isopropyl)cyclopentene
Wiley ID 1209126