For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-METHYL-2-BUTENNITRILE
SpectraBase Compound ID HmzTcS6XZfF
InChI InChI=1S/C5H7N/c1-5(2)3-4-6/h3H,1-2H3
InChIKey AUGKLUNRHYPDAM-UHFFFAOYSA-N
Mol Weight 81.12 g/mol
Molecular Formula C5H7N
Exact Mass 81.057849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FStwsmYvbsD
Name Senecionitrile
CAS Registry Number 4786-24-7
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 81.057849229 u
Formula C5H7N
InChI InChI=1S/C5H7N/c1-5(2)3-4-6/h3H,1-2H3
InChIKey AUGKLUNRHYPDAM-UHFFFAOYSA-N
Molecular Weight 81.118 g/mol
Number of Peaks 35
RI1 756
RI2 426
SMILES C(=CC#N)(C)C
SPLASH splash10-0006-9000000000-7d42a10b3523bb6fb47c
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2-Butenenitrile, 3-methyl-
Wiley ID LM_FFNSC3_1816