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1,3-Butanediol, 1,1-diphenyl-, (S)-
SpectraBase Compound ID 7dyXn5DAD6W
InChI InChI=1S/C16H18O2/c1-13(17)12-16(18,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,17-18H,12H2,1H3/t13-/m0/s1
InChIKey WAGALWVQWKDBCI-ZDUSSCGKSA-N
Mol Weight 242.32 g/mol
Molecular Formula C16H18O2
Exact Mass 242.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 577zcLH6wie
Name 1,3-Butanediol, 1,1-diphenyl-, (S)-
CAS Registry Number 73151-77-6
Comments Edited after expert review for CCl4 contamination - Original record with SpectrumID 1245500 moved to the Legacy library
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O2
InChI InChI=1S/C16H18O2/c1-13(17)12-16(18,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,13,17-18H,12H2,1H3/t13-/m0/s1
InChIKey WAGALWVQWKDBCI-ZDUSSCGKSA-N
Molecular Weight 242.318 g/mol
SMILES O[C@](CC(c1ccccc1)(c1ccccc1)O)(C)[H]
SPLASH splash10-057l-3920000000-b89b049f3eb655860597
Source of Spectrum H-67-297-0
Wiley ID 1821465