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1,2-Propanediol
SpectraBase Compound ID LcY7PiOgyqB
InChI InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3
InChIKey DNIAPMSPPWPWGF-UHFFFAOYSA-N
Mol Weight 76.09 g/mol
Molecular Formula C3H8O2
Exact Mass 76.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GDKycShKvhY
Name 1,2-Propanediol
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 76.052429496 u
Formula C3H8O2
GC Oven Program Oven temp 280oC
InChI InChI=1S/C3H8O2/c1-3(5)2-4/h3-5H,2H2,1H3
InChIKey DNIAPMSPPWPWGF-UHFFFAOYSA-N
Instrument Name Agilent 19091J-433-Agilent 5975
Ionization Type EI
Literature Reference DOI 10.1002/anie.202113152
Quality 607
SMILES OC(CO)C
SPLASH splash10-0002-9000000000-bf92dbcc0b602998a10a
Source of Spectrum ACI-61-SM20-1,2-Propanediol (DOI: 10.1002/anie.202113152)
Wiley ID 1898004