2-METHYL-1,3-DINITROBENZENE
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP001614
Dataset description:
This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP001614 contains the MS mass spectrum of 2-METHYL-1,3-DINITROBENZENE with the InChIkey XTRDKALNCIHHNI-UHFFFAOYSA-N.
Source: 2-METHYL-1,3-DINITROBENZENE
Chemical Info
InChI | InChI=1S/C7H6N2O4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3 |
---|---|
SMILES | [O-1][N+1](=O)c(c1)c(C)c(cc1)[N+1]([O-1])=O |
InChI Key | XTRDKALNCIHHNI-UHFFFAOYSA-N |
Molecular Formula | C7H6N2O4 |
Exact Mass | 182.033 g/mol |
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Additional Information
Field | Value |
---|---|
Data last updated | January 11, 2024 |
Metadata last updated | January 11, 2024 |
Created | January 11, 2024 |
Format | HTML |
License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
Id | 721bb767-8f36-4cb2-a2f3-91eb2d34ea70 |
Package id | msbnk-fac_eng_univ_tokyo-jp001614 |
Resource type | HTML |
State | active |