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4,4-Bis[1,1,2-trimethyl-2-(3-hydroxy-2-methoxymethoxy-5-methylphen-4-yl)cyclopentane]
SpectraBase Compound ID FPcN5p8zbZx
InChI InChI=1S/C34H50O6/c1-21-17-23(33(7)15-11-13-31(33,3)4)29(39-19-37-9)27(35)25(21)26-22(2)18-24(30(28(26)36)40-20-38-10)34(8)16-12-14-32(34,5)6/h17-18,35-36H,11-16,19-20H2,1-10H3/t33-,34-/m1/s1
InChIKey STNHYDBGPWXNEC-KKLWWLSJSA-N
Mol Weight 554.8 g/mol
Molecular Formula C34H50O6
Exact Mass 554.360739 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5vT4ernNDP
Name 4,4-Bis[1,1,2-trimethyl-2-(3-hydroxy-2-methoxymethoxy-5-methylphen-4-yl)cyclopentane]
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H50O6
InChI InChI=1S/C34H50O6/c1-21-17-23(33(7)15-11-13-31(33,3)4)29(39-19-37-9)27(35)25(21)26-22(2)18-24(30(28(26)36)40-20-38-10)34(8)16-12-14-32(34,5)6/h17-18,35-36H,11-16,19-20H2,1-10H3/t33-,34-/m1/s1
InChIKey STNHYDBGPWXNEC-KKLWWLSJSA-N
Molecular Weight 554.768 g/mol
SMILES Oc1c(-c2c(c(c(cc2C)[C@@]2(C(CCC2)(C)C)C)OCOC)O)c(cc(c1OCOC)[C@@]1(C(CCC1)(C)C)C)C
SPLASH splash10-004i-0001940000-488aafdf4a0765684191
Source of Spectrum KC-57-7134-20
Wiley ID 1625417