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2-Butenoic acid, 3-(1H-benzotriazol-1-yl)-, methyl ester, (E)-
SpectraBase Compound ID 7urrdzXn5aF
InChI InChI=1S/C11H11N3O2/c1-8(7-11(15)16-2)14-10-6-4-3-5-9(10)12-13-14/h3-7H,1-2H3/b8-7+
InChIKey VJVKPRMZTJJTCY-BQYQJAHWSA-N
Mol Weight 217.23 g/mol
Molecular Formula C11H11N3O2
Exact Mass 217.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FcMWdc2xnPe
Name 2-Butenoic acid, 3-(1H-benzotriazol-1-yl)-, methyl ester, (E)-
Alternate Name(s) E-methyl 3-(1-benzotriazolyl)-2-butenoate Methyl (2E)-3-(1H-1,2,3-benzotriazol-1-yl)-2-butenoate
CAS Registry Number 107097-19-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N3O2
InChI InChI=1S/C11H11N3O2/c1-8(7-11(15)16-2)14-10-6-4-3-5-9(10)12-13-14/h3-7H,1-2H3/b8-7+
InChIKey VJVKPRMZTJJTCY-BQYQJAHWSA-N
Molecular Weight 217.228 g/mol
SMILES C(\C=C/([n]1nnc2ccccc12)C)(=O)OC
SPLASH splash10-001i-1910000000-c5c8abf9dcadc5543ee0
Source of Spectrum F-42-2990-0
Wiley ID 1216451