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1-[5-[benzotriazol-1-yl(cyclopropyl)methyl]-2-methyl-3-furyl]ethanone
SpectraBase Compound ID A6GaV2U9ujF
InChI InChI=1S/C17H17N3O2/c1-10(21)13-9-16(22-11(13)2)17(12-7-8-12)20-15-6-4-3-5-14(15)18-19-20/h3-6,9,12,17H,7-8H2,1-2H3
InChIKey UXUGXWPWIFKQNF-UHFFFAOYSA-N
Mol Weight 295.34 g/mol
Molecular Formula C17H17N3O2
Exact Mass 295.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4D991m235bH
Name 1-[5-[benzotriazol-1-yl(cyclopropyl)methyl]-2-methyl-3-furyl]ethanone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 295.132076797 u
Formula C17H17N3O2
InChI InChI=1S/C17H17N3O2/c1-10(21)13-9-16(22-11(13)2)17(12-7-8-12)20-15-6-4-3-5-14(15)18-19-20/h3-6,9,12,17H,7-8H2,1-2H3
InChIKey UXUGXWPWIFKQNF-UHFFFAOYSA-N
Instrument Name Agilent 7890B-5977B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201807039
Molecular Weight 295.342 g/mol
Quality 829
SMILES C1=CC=CC=2N(N=NC12)C(C=1OC(=C(C1)C(=O)C)C)C1CC1
SPLASH splash10-004i-1910000000-d4f1b4de8cc27077c126
Source of Spectrum ACI-57-SM174-174-2 (DOI: 10.1002/anie.201807039)
Wiley ID 1896807