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2-Butynoic acid, 4-cyclopropyl-4-oxo-, ethyl ester
SpectraBase Compound ID 4JQxn5oy3af
InChI InChI=1S/C9H10O3/c1-2-12-9(11)6-5-8(10)7-3-4-7/h7H,2-4H2,1H3
InChIKey SYPBXEROLZGERL-UHFFFAOYSA-N
Mol Weight 166.18 g/mol
Molecular Formula C9H10O3
Exact Mass 166.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1hNRbDLZmC
Name 2-Butynoic acid, 4-cyclopropyl-4-oxo-, ethyl ester
Alternate Name(s) Ethyl 4-cyclopropyl-4-oxo-2-butynoate 4-cyclopropyl-4-keto-but-2-ynoic acid ethyl ester 4-cyclopropyl-4-oxo-2-butynoic acid ethyl ester Ethyl 4-cyclopropyl-4-oxidanylidene-but-2-ynoate Ethyl 4-cyclopropyl-4-oxo-but-2-ynoate
CAS Registry Number 54966-48-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O3
InChI InChI=1S/C9H10O3/c1-2-12-9(11)6-5-8(10)7-3-4-7/h7H,2-4H2,1H3
InChIKey SYPBXEROLZGERL-UHFFFAOYSA-N
Molecular Weight 166.176 g/mol
SMILES C(C#CC(OCC)=O)(=O)C1CC1
SPLASH splash10-0f6x-9100000000-6ba5d83a4e7befdf46a5
Source of Spectrum SD-1981-0-0
Wiley ID 1162139