For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5,8-Dodecanediol, 1,12-bis(phenylmethoxy)-, [S-(R*,R*)]-
SpectraBase Compound ID 8i0A6L5Mo97
InChI InChI=1S/C26H38O4/c27-25(15-7-9-19-29-21-23-11-3-1-4-12-23)17-18-26(28)16-8-10-20-30-22-24-13-5-2-6-14-24/h1-6,11-14,25-28H,7-10,15-22H2/t25-,26-/m0/s1
InChIKey PKRHDEJRRMDFTK-UIOOFZCWSA-N
Mol Weight 414.6 g/mol
Molecular Formula C26H38O4
Exact Mass 414.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1o0pphYTCxw
Name 5,8-Dodecanediol, 1,12-bis(phenylmethoxy)-, [S-(R*,R*)]-
Alternate Name(s) (5S,8S)-1,12-bis(benzyloxy)-5,8-dodecanediol (5S,8S)-1,12-bis(benzyloxy)-5,8-dodecanedol
CAS Registry Number 131618-31-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H38O4
InChI InChI=1S/C26H38O4/c27-25(15-7-9-19-29-21-23-11-3-1-4-12-23)17-18-26(28)16-8-10-20-30-22-24-13-5-2-6-14-24/h1-6,11-14,25-28H,7-10,15-22H2/t25-,26-/m0/s1
InChIKey PKRHDEJRRMDFTK-UIOOFZCWSA-N
Molecular Weight 414.586 g/mol
SMILES O[C@](CC[C@@](O)(CCCCOCc1ccccc1)[H])(CCCCOCc1ccccc1)[H]
SPLASH splash10-052b-0900000000-2ec02f6d25798d4abce5
Source of Spectrum J-56-1389-8
Wiley ID 1375625