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1H-Pyrrole, 2-(1-chloro-2,2-dimethylpropyl)-5-nitro-
SpectraBase Compound ID 8L3CK9kzDcO
InChI InChI=1S/C9H13ClN2O2/c1-9(2,3)8(10)6-4-5-7(11-6)12(13)14/h4-5,8,11H,1-3H3
InChIKey KTNBIPBCNMWUPM-UHFFFAOYSA-N
Mol Weight 216.67 g/mol
Molecular Formula C9H13ClN2O2
Exact Mass 216.066555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BD8raSGpwZ8
Name 1H-Pyrrole, 2-(1-chloro-2,2-dimethylpropyl)-5-nitro-
Alternate Name(s) 2-(1'-Chloro-2',2'-dimethylpropyl)-5-nitro-1H-pyrrole 2-(1-Chloro-2,2-dimethylpropyl)-5-nitro-1H-pyrrole
CAS Registry Number 115975-64-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13ClN2O2
InChI InChI=1S/C9H13ClN2O2/c1-9(2,3)8(10)6-4-5-7(11-6)12(13)14/h4-5,8,11H,1-3H3
InChIKey KTNBIPBCNMWUPM-UHFFFAOYSA-N
Molecular Weight 216.668 g/mol
SMILES [nH]1c(ccc1N(=O)=O)C(C(C)(C)C)Cl
SPLASH splash10-0btc-9500000000-d042d3ea1e268d343dc0
Source of Spectrum B-40-2079-15
Wiley ID 1215060