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

*Links on SpectraBase are not permalinks.
1-Naphthalenepropanoic acid, 6-cyano-5,6,7,8-tetrahydro-4-methoxy-6-(methoxymethoxy)-, methyl ester, (.+-.)-
SpectraBase Compound ID B13LF75Lkvi
InChI InChI=1S/C18H23NO5/c1-21-12-24-18(11-19)9-8-14-13(5-7-17(20)23-3)4-6-16(22-2)15(14)10-18/h4,6H,5,7-10,12H2,1-3H3
InChIKey VBQTYAHRHUEOCA-UHFFFAOYSA-N
Mol Weight 333.38 g/mol
Molecular Formula C18H23NO5
Exact Mass 333.157623 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 ALOkbhoaDNW
Name 1-Naphthalenepropanoic acid, 6-cyano-5,6,7,8-tetrahydro-4-methoxy-6-(methoxymethoxy)-, methyl ester, (.+-.)-
CAS Registry Number 80738-94-9
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO5
InChI InChI=1S/C18H23NO5/c1-21-12-24-18(11-19)9-8-14-13(5-7-17(20)23-3)4-6-16(22-2)15(14)10-18/h4,6H,5,7-10,12H2,1-3H3
InChIKey VBQTYAHRHUEOCA-UHFFFAOYSA-N
Molecular Weight 333.384 g/mol
SMILES c12c(CCC(C#N)(C2)OCOC)c(CCC(=O)OC)ccc1OC
SPLASH splash10-00ea-0493000000-6e6267b2d080f265cfcb
Source of Spectrum B-34-1916-0
Synonyms Methyl 3-(6'-cyano-4'-methoxy-6-methoxymethyloxy-5',6',7',8'-tetrahydronaphthalen-1'-yl)propanoate Methyl 3-[6-cyano-4-methoxy-6-(methoxymethoxy)-5,6,7,8-tetrahydro-1-naphthalenyl]propanoate
Wiley ID 1330211