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CAS Number: 29906-67-0
1-methyl-5-nitro-1H-indole

Structure

 1-methyl-5-nitro-1H-indole
Name: 1-methyl-5-nitro-1H-indole
Synonyms:
General Information
Product Number: 29906670

CAS Registry Number 29906-67-0
Name:
1H-?Indole, 1-?methyl-?5-?nitro-
Indole, 1-methyl-5-nitro- (8CI)
1-Methyl-5-nitro-1H-indole
1-Methyl-5-nitroindole
5-Nitro-1-methylindole
N-Methyl-5-nitroindole

 

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

InChI Key:PXBQSCHRKSBGKV-UHFFFAOYSA-N

Canonical SMILES:CN1C=CC2=C1C=CC(=C2)[N+](=O)[O-]

Specification

98%
References

PCT Int. Appl. (2015), WO 2015158204 A1 20151022.                                  

Journal of Organic Chemistry (2016), 81(17), 7771-7783.                                  
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