| SpectraBase Spectrum ID |
3Teou5J2hCg |
| Name |
1-Naphthaleneacetic acid, 2-(acetyloxy)decahydro-2,5,5,8a-tetramethyl-7-oxo-, [1R-(1.alpha.,2.beta.,4a.beta.,8a.alpha.)]- |
| Alternate Name(s) |
1-Naphthaleneacetic acid, decahydro-2-hydroxy-2,5,5,8a-tetramethyl-7-oxo-, acetate, (1R,2R,4aS,8aS)-(+)-
8.alpha.-acetoxy-2-oxo-13,14,15,16-tetranorlabdan-12-oic acid
[(1R,2S,4aS,8aS)-2-(acetyloxy)-2,5,5,8a-tetramethyl-7-oxodecahydro-1-naphthalenyl]acetic acid |
| CAS Registry Number |
29065-20-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H28O5 |
| InChI |
InChI=1S/C18H28O5/c1-11(19)23-18(5)7-6-13-16(2,3)9-12(20)10-17(13,4)14(18)8-15(21)22/h13-14H,6-10H2,1-5H3,(H,21,22)/t13-,14+,17-,18-/m0/s1 |
| InChIKey |
ALMIXQTUKWCGCU-DACLVMHWSA-N |
| Molecular Weight |
324.417 g/mol |
| SMILES |
OC(C[C@@]1([C@@]2([C@](C(C)(C)CC(C2)=O)(CC[C@@]1(OC(=O)C)C)[H])C)[H])=O |
| SPLASH |
splash10-0006-9000000000-1c9c69b1ce1b4aaa6d1c |
| Source of Spectrum |
B-42-1123-10 |
| Wiley ID |
1323214 |
![1-Naphthaleneacetic acid, 2-(acetyloxy)decahydro-2,5,5,8a-tetramethyl-7-oxo-, [1R-(1.alpha.,2.beta.,4a.beta.,8a.alpha.)]-](/api/spectrum/3Teou5J2hCg/structure.png?h=300&w=458 "1-Naphthaleneacetic acid, 2-(acetyloxy)decahydro-2,5,5,8a-tetramethyl-7-oxo-, [1R-(1.alpha.,2.beta.,4a.beta.,8a.alpha.)]-")
