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2-Methyl-6-{N-.alpha.-pyrrolidino-3'-nitrobenzyl]thiazolo[3,2-b]-1,2,4-triazol-5-ol
SpectraBase Compound ID GGbUKOvaQUW
InChI InChI=1S/C16H17N5O3S/c1-10-17-16-20(18-10)15(22)14(25-16)13(19-7-2-3-8-19)11-5-4-6-12(9-11)21(23)24/h4-6,9,13,22H,2-3,7-8H2,1H3
InChIKey PEXRGJQJGLDZEH-UHFFFAOYSA-N
Mol Weight 359.4 g/mol
Molecular Formula C16H17N5O3S
Exact Mass 359.105211 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jpzt7U6Vb7C
Name 2-Methyl-6-{N-.alpha.-pyrrolidino-3'-nitrobenzyl]thiazolo[3,2-b]-1,2,4-triazol-5-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N5O3S
InChI InChI=1S/C16H17N5O3S/c1-10-17-16-20(18-10)15(22)14(25-16)13(19-7-2-3-8-19)11-5-4-6-12(9-11)21(23)24/h4-6,9,13,22H,2-3,7-8H2,1H3
InChIKey PEXRGJQJGLDZEH-UHFFFAOYSA-N
Molecular Weight 359.404 g/mol
SMILES OC1=C(C(c2cc(N(=O)=O)ccc2)N2CCCC2)Sc2[n]1nc(C)n2
SPLASH splash10-0079-9181000000-d0281dfc4b8f81e816c7
Source of Spectrum D8-328-173-17
Synonyms 2-Methyl-5-[(3-nitrophenyl)-(1-pyrrolidinyl)methyl]-6-thiazolo[3,2-b][1,2,4]triazolol 2-Methyl-5-[(3-nitrophenyl)-pyrrolidin-1-ylmethyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol 2-Methyl-5-[(3-nitrophenyl)-pyrrolidin-1-yl-methyl]thiazolo[3,2-b][1,2,4]triazol-6-ol 2-Methyl-5-[(3-nitrophenyl)-pyrrolidin-1-yl-methyl]-[1,3]thiazolo[3,2-b][1,2,4]triazol-6-ol
Wiley ID 1515725