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

*Links on SpectraBase are not permalinks.
2-Heptene-1,5-diol, 2,4-dimethyl-4-(phenylmethoxy)-, [S-[R*,S*-(E)]]-
SpectraBase Compound ID 6vNVzFamCuI
InChI InChI=1S/C16H24O3/c1-4-15(18)16(3,10-13(2)11-17)19-12-14-8-6-5-7-9-14/h5-10,15,17-18H,4,11-12H2,1-3H3/b13-10+/t15-,16+/m1/s1
InChIKey SRANJXBESOBLKL-FCEHDVOZSA-N
Mol Weight 264.36 g/mol
Molecular Formula C16H24O3
Exact Mass 264.172545 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 1PhTKy5sdsH
Name 2-Heptene-1,5-diol, 2,4-dimethyl-4-(phenylmethoxy)-, [S-[R*,S*-(E)]]-
CAS Registry Number 98004-01-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24O3
InChI InChI=1S/C16H24O3/c1-4-15(18)16(3,10-13(2)11-17)19-12-14-8-6-5-7-9-14/h5-10,15,17-18H,4,11-12H2,1-3H3/b13-10+/t15-,16+/m1/s1
InChIKey SRANJXBESOBLKL-FCEHDVOZSA-N
Molecular Weight 264.365 g/mol
SMILES OC\C(=C\[C@@]([C@](O)(CC)[H])(OCc1ccccc1)C)C
SPLASH splash10-0006-9100000000-2b66d61f6dc7da79679f
Source of Spectrum KC-1985-13-27
Synonyms (2E,4S,5R)-4-(benzyloxy)-2,4-dimethyl-2-heptene-1,5-diol (2E,4S,5R)-4-benzyloxy-1-hydroxy-2,4-dimethylhept-2-ene[(E)-4-O-benzyl-2,3,6,7-tetradeoxy-2,4-di-c-methyl-D-erythrohept-2-enitol
Wiley ID 1268270