73148

3-Nitrobenzyl alcohol

suitable for mass spectrometry (MS), ≥99.5%

Manufacturer: Supelco

CAS Number: 619-25-0

Synonym(S): NOBA

Select a Size

Pack Size SKU Availability Price
5 G 73148-5-G In Stock ₹ 22,472.70

73148 - 5 G

₹ 22,472.70

In Stock

Quantity

1

Base Price: ₹ 22,472.70

GST (18%): ₹ 4,045.086

Total Price: ₹ 26,517.786

Quality Level

100

Assay

≥99.5% (GC)≥99.5%

form

(Powder or Crystals or Solid or Liquid)

technique(s)

H-NMR: suitablemass spectrometry (MS): suitable

bp

175-180 °C/3 mmHg (lit.)

mp

26-32 °C (lit.)

density

1.29 g/mL at 20 °C (lit.)

SMILES string

OCc1cccc(c1)[N+]([O-])=O

InChI

1S/C7H7NO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,9H,5H2

InChI key

CWNPOQFCIIFQDM-UHFFFAOYSA-N

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Description

  • 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.[1]
  • Application: 3-NBA has been used as liquid matrix in Ionization in liquid secondary ion mass spectrometry.[2]
  • Other Notes: Matrix used in fast atom bombardment mass spectrometry[3][4][5]

SAFETY INFORMATION

WGK

WGK 3

Flash Point(F)

233.6 °F

Flash Point(C)

112 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Quality Level:
100

Assay:
≥99.5% (GC)≥99.5%

form:
(Powder or Crystals or Solid or Liquid)

technique(s):
H-NMR: suitablemass spectrometry (MS): suitable

bp:
175-180 °C/3 mmHg (lit.)

mp:
26-32 °C (lit.)

density:
1.29 g/mL at 20 °C (lit.)

SMILES string:
OCc1cccc(c1)[N+]([O-])=O

InChI:
1S/C7H7NO3/c9-5-6-2-1-3-7(4-6)8(10)11/h1-4,9H,5H2

InChI key:
CWNPOQFCIIFQDM-UHFFFAOYSA-N

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2.090 g/mL at 25 °C

SMILES string:
IC1COC1

InChI:
1S/C3H5IO/c4-3-1-5-2-3/h3H,1-2H2

InChI key:
KBEIFKMKVCDETC-UHFFFAOYSA-N

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SMILES string:
OC(=O)c1cc(Cc2cc(cc(c2)C(O)=O)C(O)=O)cc(c1)C(O)=O

InChI:
1S/C17H12O8/c18-14(19)10-2-8(3-11(6-10)15(20)21)1-9-4-12(16(22)23)7-13(5-9)17(24)25/h2-7H,1H2,(H,18,19)(H,20,21)(H,22,23)(H,24,25)

InChI key:
RAESDWWKTFZWJA-UHFFFAOYSA-N