For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
methyl 5-[benzotriazol-1-yl(phenyl)methyl]-2-methyl-furan-3-carboxylate
SpectraBase Compound ID 55j1OCR6eN0
InChI InChI=1S/C20H17N3O3/c1-13-15(20(24)25-2)12-18(26-13)19(14-8-4-3-5-9-14)23-17-11-7-6-10-16(17)21-22-23/h3-12,19H,1-2H3
InChIKey OWURRQPBUCUWQY-UHFFFAOYSA-N
Mol Weight 347.37 g/mol
Molecular Formula C20H17N3O3
Exact Mass 347.126991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GTKuJBWRTy4
Name methyl 5-[benzotriazol-1-yl(phenyl)methyl]-2-methyl-furan-3-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 347.126991416 u
Formula C20H17N3O3
InChI InChI=1S/C20H17N3O3/c1-13-15(20(24)25-2)12-18(26-13)19(14-8-4-3-5-9-14)23-17-11-7-6-10-16(17)21-22-23/h3-12,19H,1-2H3
InChIKey OWURRQPBUCUWQY-UHFFFAOYSA-N
Instrument Name Agilent 7890B-5977B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201807039
Molecular Weight 347.374 g/mol
Quality 843
SMILES C1=CC=CC=2N(N=NC12)C(C=1OC(=C(C1)C(=O)OC)C)C1=CC=CC=C1
SPLASH splash10-004i-1491000000-3ec6235529ef73ac983f
Source of Spectrum ACI-57-SM177-177-2 (DOI: 10.1002/anie.201807039)
Wiley ID 1896810