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

*Links on SpectraBase are not permalinks.
4,7-Methano-1H-indene-3-acetic acid, 3a,4,7,7a-tetrahydro-1-hydroxy-.alpha.-methyl-, [1.alpha.,3(R*),3a.alpha.,4.alpha.,7.alpha.,7a.alpha.]-
SpectraBase Compound ID 1DX6aQt77cI
InChI InChI=1S/C13H16O3/c1-6(13(15)16)9-5-10(14)12-8-3-2-7(4-8)11(9)12/h2-3,5-8,10-12,14H,4H2,1H3,(H,15,16)/t6?,7-,8+,10?,11-,12+/m1/s1
InChIKey NDUROSIPBWIVKV-ZVZFBEFYSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 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 CWB4hgr4ZnL
Name 4,7-Methano-1H-indene-3-acetic acid, 3a,4,7,7a-tetrahydro-1-hydroxy-.alpha.-methyl-, [1.alpha.,3(R*),3a.alpha.,4.alpha.,7.alpha.,7a.alpha.]-
CAS Registry Number 110678-39-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-6(13(15)16)9-5-10(14)12-8-3-2-7(4-8)11(9)12/h2-3,5-8,10-12,14H,4H2,1H3,(H,15,16)/t6?,7-,8+,10?,11-,12+/m1/s1
InChIKey NDUROSIPBWIVKV-ZVZFBEFYSA-N
Molecular Weight 220.268 g/mol
SMILES OC1[C@]2([C@@](C(C(C(=O)O)C)=C1)([C@@]1(C=C[C@]2(C1)[H])[H])[H])[H]
SPLASH splash10-0a4i-6910000000-0fd6716b7e2dfbb3b809
Wiley ID 1487336