John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=13vabxekwts SpectraBase Spectrum ID=B13B0WiYYSW

(accessed ).
Isobutylnitrite
SpectraBase Compound ID 13vabxekwts
InChI InChI=1S/C4H9NO2/c1-4(2)3-7-5-6/h4H,3H2,1-2H3
InChIKey APNSGVMLAYLYCT-UHFFFAOYSA-N
Mol Weight 103.12 g/mol
Molecular Formula C4H9NO2
Exact Mass 103.063329 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID B13B0WiYYSW
Name Isobutylnitrite
CAS Registry Number 542-56-3
Classification Vasodilator
Comments Spectrum verified by independent measurements in external laboratories; Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Database Compilation Copyright © 2020 Wiley-VCH Verlag GmbH & Co. KGaA. Copyright © 2020 DigiLab GmbH. All Rights Reserved.
Formula C4H9NO2
InChI InChI=1S/C4H9NO2/c1-4(2)3-7-5-6/h4H,3H2,1-2H3
InChIKey APNSGVMLAYLYCT-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Source of Spectrum DigiLab GmbH (C) 2020
SpectraBase Batch ID 6z11u2LgVtz
Technique GC/MS
Wiley ID DD2020_020932