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

*Links on SpectraBase are not permalinks.

2-Acetoxy-aristotetralone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-Acetoxy-aristotetralone
SpectraBase Compound ID H0Mfr6nSfv7
InChI InChI=1S/C23H24O7/c1-12-21(14-6-7-17-20(8-14)29-11-28-17)15-9-18(26-4)19(27-5)10-16(15)22(25)23(12,3)30-13(2)24/h6-10,12,21H,11H2,1-5H3/t12-,21-,23-/m1/s1
InChIKey GCGRBXGJMOHAIS-WLFWSYEOSA-N
Mol Weight 412.44 g/mol
Molecular Formula C23H24O7
Exact Mass 412.152203 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID IblGo0sJaIq
Name 2-Acetoxy-aristotetralone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 412.152203106 u
Formula C23H24O7
InChI InChI=1S/C23H24O7/c1-12-21(14-6-7-17-20(8-14)29-11-28-17)15-9-18(26-4)19(27-5)10-16(15)22(25)23(12,3)30-13(2)24/h6-10,12,21H,11H2,1-5H3/t12-,21-,23-/m1/s1
InChIKey GCGRBXGJMOHAIS-WLFWSYEOSA-N
Molecular Weight 412.438 g/mol
SMILES [C@]1(C(C=2C=C(OC)C(=CC2[C@]([C@]1(C)[H])(C=1C=C2OCOC2=CC1)[H])OC)=O)(OC(=O)C)C