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(2E)-2,3-Dimethyl-2-pentenoic acid
SpectraBase Compound ID JhrJo40dg6y
InChI InChI=1S/C7H12O2/c1-4-5(2)6(3)7(8)9/h4H2,1-3H3,(H,8,9)/b6-5+
InChIKey URRYFCLLPGIYQS-AATRIKPKSA-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 J67liXc8NrG
Name (2E)-2,3-Dimethyl-2-pentenoic acid
CAS Registry Number 122630-51-7
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/h4H2,1-3H3,(H,8,9)/b6-5+
InChIKey URRYFCLLPGIYQS-AATRIKPKSA-N
Molecular Weight 128.171 g/mol
SMILES OC(\C(=C\(CC)C)C)=O
SPLASH splash10-056u-9100000000-64b725db8f5ad51ae7ac
Source of Spectrum HE-1986-220-0
Synonyms (E)-2,3-dimethyl-2-pentenoic acid (E)-2,3-dimethylpent-2-enoic acid 2,3-Dimethyl-2-pentenoic acid 2-Pentenoic acid, 2,3-dimethyl-
Wiley ID 1131138