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3-Cyclobutene-1,2-dicarboxylic acid, 1-butyl ester, cis-
SpectraBase Compound ID ELA2WluR8uF
InChI InChI=1S/C10H14O4/c1-2-3-6-14-10(13)8-5-4-7(8)9(11)12/h4-5,7-8H,2-3,6H2,1H3,(H,11,12)/t7-,8+/m0/s1
InChIKey LFOWZSCNCUPBRS-JGVFFNPUSA-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 EOAhLcwl74w
Name 3-Cyclobutene-1,2-dicarboxylic acid, 1-butyl ester, cis-
Alternate Name(s) (1S,4R)-4-butoxycarbonylcyclobut-2-ene-1-carboxylic acid (1S,4R)-4-[butoxy(oxo)methyl]-1-cyclobut-2-enecarboxylic acid
CAS Registry Number 87729-18-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14O4
InChI InChI=1S/C10H14O4/c1-2-3-6-14-10(13)8-5-4-7(8)9(11)12/h4-5,7-8H,2-3,6H2,1H3,(H,11,12)/t7-,8+/m0/s1
InChIKey LFOWZSCNCUPBRS-JGVFFNPUSA-N
Molecular Weight 198.218 g/mol
SMILES OC([C@]1(C=C[C@]1(C(=O)OCCCC)[H])[H])=O
SPLASH splash10-054n-9200000000-d46a0bcf0e5078f0c48d
Source of Spectrum J-49-464-0
Wiley ID 1195170