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3-Butenoic acid, 2,2,3-trimethyl-
SpectraBase Compound ID GbXYenh07WM
InChI InChI=1S/C7H12O2/c1-5(2)7(3,4)6(8)9/h1H2,2-4H3,(H,8,9)
InChIKey SZVHSAUMBGHOSC-UHFFFAOYSA-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 Cw9jko4lutP
Name 3-Butenoic acid, 2,2,3-trimethyl-
CAS Registry Number 4168-01-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O2
InChI InChI=1S/C7H12O2/c1-5(2)7(3,4)6(8)9/h1H2,2-4H3,(H,8,9)
InChIKey SZVHSAUMBGHOSC-UHFFFAOYSA-N
Molecular Weight 128.171 g/mol
SMILES OC(C(C(=C)C)(C)C)=O
SPLASH splash10-06sl-9300000000-3a8d59e2fa408531fa5c
Source of Spectrum OS-6-456-0
Synonyms 2,2,3-Trimethyl-3-butenoic acid 2,2,3-trimethylbut-3-enoic acid
Wiley ID 1131140