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3-Phenyl-2-propynoic acid tert-butyl ester
SpectraBase Compound ID 6SuT8YUGTwv
InChI InChI=1S/C13H14O2/c1-13(2,3)15-12(14)10-9-11-7-5-4-6-8-11/h4-8H,1-3H3
InChIKey PXJDPDIARGPKJY-UHFFFAOYSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LQioCgJku2a
Name 3-Phenyl-2-propynoic acid tert-butyl ester
Alternate Name(s) 3-Phenylpropiolic acid tert-butyl ester tert-Butyl 3-phenylprop-2-ynoate
CAS Registry Number 93139-50-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-13(2,3)15-12(14)10-9-11-7-5-4-6-8-11/h4-8H,1-3H3
InChIKey PXJDPDIARGPKJY-UHFFFAOYSA-N
Molecular Weight 202.253 g/mol
SMILES C(#Cc1ccccc1)C(OC(C)(C)C)=O
SPLASH splash10-004j-0900000000-613f3b02c04dd160ffc2
Source of Spectrum C-112-7036-3
Wiley ID 1200072