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Chrysanthemumdicarboxylic acid
SpectraBase Compound ID 9aqFt5OzITq
InChI InChI=1S/C10H14O4/c1-5(8(11)12)4-6-7(9(13)14)10(6,2)3/h4,6-7H,1-3H3,(H,11,12)(H,13,14)/b5-4+
InChIKey XXTFGUFRXPWYDA-SNAWJCMRSA-N
Mol Weight 198.22 g/mol
Molecular Formula C10H14O4
Exact Mass 198.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5EKzNbEKMdh
Name Chrysanthemumdicarboxylic acid
CAS Registry Number 22413-50-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-5(8(11)12)4-6-7(9(13)14)10(6,2)3/h4,6-7H,1-3H3,(H,11,12)(H,13,14)/b5-4+
InChIKey XXTFGUFRXPWYDA-SNAWJCMRSA-N
Molecular Weight 198.218 g/mol
SMILES OC(C1C(\C=C\(C(O)=O)C)C1(C)C)=O
SPLASH splash10-052f-9600000000-1208c58e52d97ec6fc9c
Source of Spectrum O-7-728-4
Synonyms (+)-3-(2-Carboxy-cis-propenyl)-2,2-dimethylcyclopropane-trans-1-carboxylic acid, [1R-[1.alpha.,3.beta.(Z)]]- (+-)-3-(2-Carboxy-cis-propenyl)-2,2-dimethylcyclopropane-cis-1-carboxylic acid, [1.alpha., 3.beta.(Z)]- Cyclopropanecarboxylic acid, 3-(2-carboxy-1-propenyl)-2,2-dimethyl- (+-)-3-(2-Carboxy-cis-propenyl)-2,2-dimethylcyclopropane-trans-1-carboxylic acid, [1.alpha., 3.beta.(Z)]- 2,2-Dimethyl-3-[(E)-2-methyl-3-oxidanyl-3-oxidanylidene-prop-1-enyl]cyclopropane-1-carboxylic acid 3-[(E)-3-hydroxy-2-methyl-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid 3-[(E)-2-carboxyprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid 3-[(E)-2-carboxyprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylic acid
Wiley ID 1195167