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benzoic acid 1-benzotriazolylmethyl ester

View entire compound with spectra: 1 MS (GC)

benzoic acid 1-benzotriazolylmethyl ester
SpectraBase Compound ID 3rZBws9W1vC
InChI InChI=1S/C14H11N3O2/c18-14(11-6-2-1-3-7-11)19-10-17-13-9-5-4-8-12(13)15-16-17/h1-9H,10H2
InChIKey JGMDINVNKRYAMC-UHFFFAOYSA-N
Mol Weight 253.26 g/mol
Molecular Formula C14H11N3O2
Exact Mass 253.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bq1sDRmRDRu
Name benzoic acid 1-benzotriazolylmethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11N3O2
InChI InChI=1S/C14H11N3O2/c18-14(11-6-2-1-3-7-11)19-10-17-13-9-5-4-8-12(13)15-16-17/h1-9H,10H2
InChIKey JGMDINVNKRYAMC-UHFFFAOYSA-N
Molecular Weight 253.261 g/mol
SMILES C(c1ccccc1)(=O)OC[n]1nnc2c1cccc2
SPLASH splash10-004i-9410000000-404316e419fd480fa0d4
Source of Spectrum SO-0-70-3
Synonyms benzoic acid benzotriazol-1-ylmethyl ester
Wiley ID 1541928