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1-Cycloheptene-1-acetic acid, .alpha.,.alpha.-dimethyl-
SpectraBase Compound ID A1XAZSJdOG1
InChI InChI=1S/C11H18O2/c1-11(2,10(12)13)9-7-5-3-4-6-8-9/h7H,3-6,8H2,1-2H3,(H,12,13)
InChIKey KYBMDQKBPBFTEQ-UHFFFAOYSA-N
Mol Weight 182.26 g/mol
Molecular Formula C11H18O2
Exact Mass 182.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjQxL30wpu4
Name 1-Cycloheptene-1-acetic acid, .alpha.,.alpha.-dimethyl-
CAS Registry Number 16642-56-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O2
InChI InChI=1S/C11H18O2/c1-11(2,10(12)13)9-7-5-3-4-6-8-9/h7H,3-6,8H2,1-2H3,(H,12,13)
InChIKey KYBMDQKBPBFTEQ-UHFFFAOYSA-N
Molecular Weight 182.263 g/mol
SMILES OC(C(C)(C)C=1CCCCCC1)=O
SPLASH splash10-015j-9200000000-7212c4bdfc6d9b489cd7
Source of Spectrum OS-6-447-0
Synonyms 2-(1-Cyclohepten-1-yl)-2-methylpropanoic acid 2,2-Dimethyl-2-cyclohept-1-ene acetic acid 2-(1-cycloheptenyl)-2-methylpropanoic acid 2-(cyclohepten-1-yl)-2-methyl-propanoic acid 2-(cyclohepten-1-yl)-2-methyl-propionic acid
Wiley ID 1178692