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1-Ethyl-2-butynyl 4-ethylbenzoate
SpectraBase Compound ID 6bhXzCgv3Y6
InChI InChI=1S/C15H18O2/c1-4-7-14(6-3)17-15(16)13-10-8-12(5-2)9-11-13/h8-11,14H,5-6H2,1-3H3
InChIKey ILJACNQHGIRAAX-UHFFFAOYSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AM1mQkcknnf
Name 1-Ethyl-2-butynyl 4-ethylbenzoate
Alternate Name(s) 4-Ethylbenzoic acid, hex-4-yn-3-yl ester 4-Ethylbenzoic acid hex-4-yn-3-yl ester 1-Ethylbut-2-ynyl 4-ethylbenzoate Hex-4-yn-3-yl 4-ethylbenzoate
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Formula C15H18O2
InChI InChI=1S/C15H18O2/c1-4-7-14(6-3)17-15(16)13-10-8-12(5-2)9-11-13/h8-11,14H,5-6H2,1-3H3
InChIKey ILJACNQHGIRAAX-UHFFFAOYSA-N
Molecular Weight 230.307 g/mol
SMILES C(=O)(OC(C#CC)CC)c1ccc(CC)cc1
SPLASH splash10-001i-3900000000-578ad0e76506ef810402
Source of Spectrum NP-5-9420-0
Wiley ID 1105324