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CAS Number: 165250-69-1
4-methyl-5-nitro-1H-indole

Structure

 4-methyl-5-nitro-1H-indole
Name: 4-methyl-5-nitro-1H-indole
Synonyms:
General Information
Product Number: 165250691

CAS Registry Number 165250-69-1
Name:
1H-?Indole, 4-?methyl-?5-?nitro-
4-Methyl-5-nitro-1H-indole

 

Chemical Formula: C9H8N2O2
Exact Mass: 176.06
Molecular Weight: 176.17
m/z: 176.06 (100.0%), 177.06 (10.6%)

 

InChI:InChI=1S/C9H8N2O2/c1-6-7-4-5-10-8(7)2-3-9(6)11(12)13/h2-5,10H,1H3

InChI Key:XRJNLFAXLSBIDS-UHFFFAOYSA-N

Canonical SMILES:CC1=C(C=CC2=C1C=CN2)[N+](=O)[O-]

Specification

98%
References

PCT Int. Appl. (2015), WO 2015015378 A2 20150205.

PCT Int. Appl. (2014), WO 2014069510 A1 20140508.                                 
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