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(2S,3S)-2,3-Dimethyl-4-pentenoic acid

View entire compound with spectra: 1 MS (GC)

(2S,3S)-2,3-Dimethyl-4-pentenoic acid
SpectraBase Compound ID HnIYdeqJjia
InChI InChI=1S/C7H12O2/c1-4-5(2)6(3)7(8)9/h4-6H,1H2,2-3H3,(H,8,9)/t5-,6-/m0/s1
InChIKey NYXARVSETVGSTO-WDSKDSINSA-N
Mol Weight 128.17 g/mol
Molecular Formula C7H12O2
Exact Mass 128.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3tHnjojGtUP
Name (2S,3S)-2,3-Dimethyl-4-pentenoic acid
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-4-5(2)6(3)7(8)9/h4-6H,1H2,2-3H3,(H,8,9)/t5-,6-/m0/s1
InChIKey NYXARVSETVGSTO-WDSKDSINSA-N
Molecular Weight 128.171 g/mol
SMILES OC([C@]([C@](C=C)(C)[H])(C)[H])=O
SPLASH splash10-0a4i-9000000000-6c47825c5a96d683ac51
Source of Spectrum J-62-4447-10
Wiley ID 1131414