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3-Nitrobenzyl alcohol

SIAL/73148 - suitable for mass spectrometry (MS), ≥99.5%

Synonym: NOBA

CAS Number: 619-25-0
Empirical Formula (Hill Notation): C7H7NO3
Molecular Weight: 153.14
EC Number: 210-588-2
MDL Number: MFCD00007273
Linear Formula: O2NC6H4CH2OH
Product Type: Chemical

Catalog Number PKG Qty. Price Quantity
45-73148-5G 5 g
$211.00
1/EA
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assay ≥99.5%
  ≥99.5% (GC)
bp 175-180 °C/3 mmHg (lit.)
density 1.29 g/mL at 20 °C (lit.)
form (Powder or Crystals or Solid or Liquid)
InChI 1S/C7H7NO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,9H,5H2
InChI key CWNPOQFCIIFQDM-UHFFFAOYSA-N
mp 26-32 °C (lit.)
Quality Level 100 
SMILES string OCc1cccc(c1)[N+]([O-])=O
technique(s) H-NMR: suitable
  mass spectrometry (MS): suitable
Application: 3-NBA has been used as liquid matrix in Ionization in liquid secondary ion mass spectrometry.
General description: 3-Nitrobenzyl alcohol (3-NBA) is most commonly used matrix for spectrometry methods. It helps in the analysis of porphyrins, cyclic peptides, alkali metal cationized fatty acids for collisional activation and also certain organoruthenium compounds.
Other Notes: Matrix used in fast atom bombardment mass spectrometry
RIDADR NONH for all modes of transport
WGK Germany WGK 3
Flash Point(F) 233.6 °F - closed cup
Flash Point(C) 112 °C - closed cup
Purity ≥99.5% (GC); ≥99.5%
bp 175-180 °C/3 mmHg (lit.)
mp 26-32 °C (lit.)
Density 1.29 g/mL at 20 °C (lit.)
UNSPSC 12000000

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