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

*Links on SpectraBase are not permalinks.
(2S,3R)-3-Hydroxy-2-methyl-7-octynoic acid
SpectraBase Compound ID DmATiFBk3g0
InChI InChI=1S/C9H14O3/c1-3-4-5-6-8(10)7(2)9(11)12/h1,7-8,10H,4-6H2,2H3,(H,11,12)/t7-,8+/m0/s1
InChIKey KCPJGPVIEUCSOK-JGVFFNPUSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 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 8saSOFO3CwW
Name (2S,3R)-3-Hydroxy-2-methyl-7-octynoic acid
Alternate Name(s) (2S,3R)-2-methyl-3-oxidanyl-oct-7-ynoic acid (2S,3R)-3-hydroxy-2-methyl-oct-7-ynoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-3-4-5-6-8(10)7(2)9(11)12/h1,7-8,10H,4-6H2,2H3,(H,11,12)/t7-,8+/m0/s1
InChIKey KCPJGPVIEUCSOK-JGVFFNPUSA-N
Molecular Weight 170.208 g/mol
SMILES OC([C@]([C@](O)(CCCC#C)[H])(C)[H])=O
SPLASH splash10-00di-9200000000-d3e765ef490c09fffd38
Source of Spectrum C-118-11641-12
Wiley ID 760069