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1-[2'-(CHLOROMETHYL)-BENZYL]-3-HYDROXY-5-NITROINDAZOLE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-[2'-(CHLOROMETHYL)-BENZYL]-3-HYDROXY-5-NITROINDAZOLE
SpectraBase Compound ID 7zxX0ETtEE7
InChI InChI=1S/C15H12ClN3O3/c16-8-10-3-1-2-4-11(10)9-18-14-6-5-12(19(21)22)7-13(14)15(20)17-18/h1-7H,8-9H2,(H,17,20)
InChIKey LMSVNBPLEMOWBR-UHFFFAOYSA-N
Mol Weight 317.73 g/mol
Molecular Formula C15H12ClN3O3
Exact Mass 317.056719 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YcjDZqD8xT
Name 1-[2-(chloromethyl)benzyl]-5-nitro-indazolin-3-one
Alternate Name(s) 1-[[2-(chloromethyl)phenyl]methyl]-5-nitro-2H-indazol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClN3O3
InChI InChI=1S/C15H12ClN3O3/c16-8-10-3-1-2-4-11(10)9-18-14-6-5-12(19(21)22)7-13(14)15(20)17-18/h1-7H,8-9H2,(H,17,20)
InChIKey LMSVNBPLEMOWBR-UHFFFAOYSA-N
Molecular Weight 317.732 g/mol
SMILES Oc1n[n](c2c1cc(N(=O)=O)cc2)Cc1c(CCl)cccc1
SPLASH splash10-0f79-1930000000-6ee6ad7e301dce795488
Source of Spectrum KC-1993-1125-17
Wiley ID 777972