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o-(CYANOAMINO)BENZOIC ACID, METHYL ESTER
SpectraBase Compound ID BXCIjS9WBoC
InChI InChI=1S/C9H8N2O2/c1-13-9(12)7-4-2-3-5-8(7)11-6-10/h2-5,11H,1H3
InChIKey NIWMRDYWPIQTRD-UHFFFAOYSA-N
Mol Weight 176.17 g/mol
Molecular Formula C9H8N2O2
Exact Mass 176.058578 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2JEO4HIFRw
Name Methyl 2-(cyanoamino)benzoate
Alternate Name(s) 2-(cyanoamino)benzoic acid methyl ester Benzoic acid, 2-cyanamino-, methyl ester
CAS Registry Number 73095-45-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2O2
InChI InChI=1S/C9H8N2O2/c1-13-9(12)7-4-2-3-5-8(7)11-6-10/h2-5,11H,1H3
InChIKey NIWMRDYWPIQTRD-UHFFFAOYSA-N
Molecular Weight 176.175 g/mol
SMILES N(C#N)c1c(C(=O)OC)cccc1
SPLASH splash10-004i-4900000000-316e6189fee020b98960
Source of Spectrum AD-0-2532-0
Wiley ID 1428457