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isocyanic acid, isopropyl ester
SpectraBase Compound ID JMOiRWm3VIc
InChI InChI=1S/C4H7NO/c1-4(2)5-3-6/h4H,1-2H3
InChIKey GSLTVFIVJMCNBH-UHFFFAOYSA-N
Mol Weight 85.11 g/mol
Molecular Formula C4H7NO
Exact Mass 85.052764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1nTECH3hei
Name Propane, 2-isocyanato-
Alternate Name(s) (CH3)2CHNCO 2-Isocyanatopropane Isocyanic acid, isopropyl ester ISOPROPYL ISOCYANATE AI3-28282 EINECS 217-276-5 UN2483
CAS Registry Number 1795-48-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H7NO
InChI InChI=1S/C4H7NO/c1-4(2)5-3-6/h4H,1-2H3
InChIKey GSLTVFIVJMCNBH-UHFFFAOYSA-N
Molecular Weight 85.106 g/mol
SMILES CC(C)N=C=O
SPLASH splash10-0006-9000000000-d48ef91199e3895ede9c
Source of Spectrum EX-1969-152-76
Wiley ID 1116154