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3-Nitro-2-(pyrrolidin-1-yl)benzoic acid
SpectraBase Compound ID FIzah8UpIzW
InChI InChI=1S/C11H12N2O4/c14-11(15)8-4-3-5-9(13(16)17)10(8)12-6-1-2-7-12/h3-5H,1-2,6-7H2,(H,14,15)
InChIKey TZXHPSXCEZFUID-UHFFFAOYSA-N
Mol Weight 236.23 g/mol
Molecular Formula C11H12N2O4
Exact Mass 236.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7vX8hDPCYMG
Name 3-Nitro-2-(pyrrolidin-1-yl)benzoic acid
Alternate Name(s) 3-Nitro-2-(1-pyrrolidinyl)benzoic acid 3-Nitro-2-pyrrolidin-1-ylbenzoic acid 3-Nitro-2-pyrrolidin-1-yl-benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12N2O4
InChI InChI=1S/C11H12N2O4/c14-11(15)8-4-3-5-9(13(16)17)10(8)12-6-1-2-7-12/h3-5H,1-2,6-7H2,(H,14,15)
InChIKey TZXHPSXCEZFUID-UHFFFAOYSA-N
Molecular Weight 236.227 g/mol
SMILES OC(c1c(c(N(=O)=O)ccc1)N1CCCC1)=O
SPLASH splash10-0uxs-3920000000-64c9c0d5ab53a08238c7
Source of Spectrum IY-2-5131-0
Wiley ID 1659293