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Isobutyl nitrate
SpectraBase Compound ID 16aH54Tes3A
InChI InChI=1S/C4H9NO3/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H3
InChIKey LNNXFUZKZLXPOF-UHFFFAOYSA-N
Mol Weight 119.12 g/mol
Molecular Formula C4H9NO3
Exact Mass 119.058243 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID II9HWz1NTAd
Name Isobutyl nitrate
Source of Sample Sigma-Aldrich Company LLC
Catalog Number 472697
Lot Number 02616HE
Boiling Point 123.0 °C
CAS Registry Number 543-29-3
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H9NO3
InChI InChI=1S/C4H9NO3/c1-4(2)3-8-5(6)7/h4H,3H2,1-2H3
InChIKey LNNXFUZKZLXPOF-UHFFFAOYSA-N
Molecular Weight 119.120 g/mol
Purity 96%
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Source Nd:YAG
SMILES N(=O)(=O)OCC(C)C
Source of Spectrum Forensic Spectral Research
Synonyms 2-Methylpropyl nitrite
Technique FT-Raman