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2,4-Pentadienoic acid, 2-azido-5-phenyl-, methyl ester
SpectraBase Compound ID 5KYVZaeh8Nh
InChI InChI=1S/C12H11N3O2/c1-17-12(16)11(14-15-13)9-5-8-10-6-3-2-4-7-10/h2-9H,1H3/b8-5-,11-9+
InChIKey CLVBIIZLIRGDIZ-TWGJSUAUSA-N
Mol Weight 229.24 g/mol
Molecular Formula C12H11N3O2
Exact Mass 229.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 52Iws5PqsVe
Name 2,4-Pentadienoic acid, 2-azido-5-phenyl-, methyl ester
Alternate Name(s) Methyl (2E,4Z)-2-azido-5-phenyl-2,4-pentadienoate Methyl 2-azido-5-phenyl-2,4-pentadienecarboxylate
CAS Registry Number 72078-32-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3O2
InChI InChI=1S/C12H11N3O2/c1-17-12(16)11(14-15-13)9-5-8-10-6-3-2-4-7-10/h2-9H,1H3/b8-5-,11-9+
InChIKey CLVBIIZLIRGDIZ-TWGJSUAUSA-N
Molecular Weight 229.239 g/mol
SMILES C(\C(N=[N+]=[N-])=C/C=C\c1ccccc1)(=O)OC
SPLASH splash10-014l-0910000000-20fbf62071403ac7b37b
Source of Spectrum AH-119-577-1
Wiley ID 1230675