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1,3-Butanediol
SpectraBase Compound ID 1czjUsz0GPI
InChI InChI=1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3
InChIKey PUPZLCDOIYMWBV-UHFFFAOYSA-N
Mol Weight 90.12 g/mol
Molecular Formula C4H10O2
Exact Mass 90.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4KhU5dSuXo
Name 1,3-Butanediol
CAS Registry Number 107-88-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H10O2
InChI InChI=1S/C4H10O2/c1-4(6)2-3-5/h4-6H,2-3H2,1H3
InChIKey PUPZLCDOIYMWBV-UHFFFAOYSA-N
Molecular Weight 90.122 g/mol
SMILES OC(CCO)C
SPLASH splash10-002g-9000000000-4e3ded1a2732420ee727
Source of Spectrum NP-0-1120-0
Synonyms (S)-(+)-1,3-Butanediol .beta.-Butylene glycol 1,3-Butandiol 1,3-Butanediol, (R)- 1,3-Butanediol, (S)- 1,3-Butylene glycol 1,3-Butylenglykol 1,3-Dihydroxybutane 1-Methyl-1,3-propanediol Butane-1,3-diol Butylene glycol Methyltrimethylene glycol AI3-11077 BRN 1731276 CASWELL NO. 128GG EINECS 203-529-7 HSDB 153 NSC 402145
Wiley ID 1094474