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

*Links on SpectraBase are not permalinks.
(1S,2R)-2-[6'-Methoxy-2'-((R)-1",1"-dimethoxybut-3"-yl)-8'-methyl-2'-(methoxycarbonyl)-1',2',3',4'-tetrahydronaphthalen-1'-yl]acetic acid
SpectraBase Compound ID BzcBQpaoK07
InChI InChI=1S/C22H32O7/c1-13-9-16(26-3)11-15-7-8-22(21(25)29-6,14(2)10-19(27-4)28-5)17(20(13)15)12-18(23)24/h9,11,14,17,19H,7-8,10,12H2,1-6H3,(H,23,24)/t14-,17+,22-/m1/s1
InChIKey CMRGGDIRYGTUOG-AOSWFRPUSA-N
Mol Weight 408.5 g/mol
Molecular Formula C22H32O7
Exact Mass 408.214803 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 5nffS3nudUJ
Name (1S,2R)-2-[6'-Methoxy-2'-((R)-1",1"-dimethoxybut-3"-yl)-8'-methyl-2'-(methoxycarbonyl)-1',2',3',4'-tetrahydronaphthalen-1'-yl]acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32O7
InChI InChI=1S/C22H32O7/c1-13-9-16(26-3)11-15-7-8-22(21(25)29-6,14(2)10-19(27-4)28-5)17(20(13)15)12-18(23)24/h9,11,14,17,19H,7-8,10,12H2,1-6H3,(H,23,24)/t14-,17+,22-/m1/s1
InChIKey CMRGGDIRYGTUOG-AOSWFRPUSA-N
Molecular Weight 408.491 g/mol
SMILES OC(C[C@@]1([C@@]([C@@](CC(OC)OC)(C)[H])(C(=O)OC)CCc2cc(OC)cc(c12)C)[H])=O
SPLASH splash10-000i-9010000000-87c32efcc1c1b63f50ec
Source of Spectrum B-52-1105-37
Synonyms (1S,2R)-2-[6'-Methoxy-2'-((R)-1'',1''-dimethoxybut-3''-yl)-8'-methyl-2'-(methoxycarbonyl)-1',2',3',4'-tetrahydronaphthalen-1'-yl]acetic acid 2-[6'-Methoxy-2'-(1'',1''-dimethoxybut-3''-yl)-8'-methyl-2'-(methoxycarbonyl)-1',2',3',4'-tetrahydronaphthalen-1'-yl]acetic acid 2-[6'-Methoxy-2'-(1'',1''-dimethoxybut-3''-yl)-8'-methyl-2'-(methoxycarbonyl)-1',2',3',4'-tetrahydronaphthalen-1'-yl]acetic acid [(1S,2R)-2-[(1R)-3,3-dimethoxy-1-methylpropyl]-6-methoxy-2-(methoxycarbonyl)-8-methyl-1,2,3,4-tetrahydro-1-naphthalenyl]acetic acid
Wiley ID 746836