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Isobutanol
SpectraBase Compound ID 80hsIXZuf2k
InChI InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
InChIKey ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
Mol Weight 74.12 g/mol
Molecular Formula C4H10O
Exact Mass 74.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 458RKF2JSG6
Name 2-Methyl-1-propanol (isobutanol)
CAS Registry Number 78-83-1
Classification Solvent
Comments Original RI info: <1000*
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Exact Mass 74.073164941 u
Formula C4H10O
InChI InChI=1S/C4H10O/c1-4(2)3-5/h4-5H,3H2,1-2H3
InChIKey ZXEKIIBDNHEJCQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 74.123 g/mol
SMILES CC(CO)C
SPLASH splash10-0006-9000000000-7bf6c041f68bb0e7aa9f
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1042