| SpectraBase Spectrum ID |
CS2H9NzmWMA |
| Name |
2-Propenoic acid, 3-[5-(hydroxymethyl)-2,6,6-trimethyl-2-cyclohexen-1-yl]-, [1.alpha.(E),5.alpha.]-(.+-.)- |
| CAS Registry Number |
107890-62-0 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H20O3 |
| InChI |
InChI=1S/C13H20O3/c1-9-4-5-10(8-14)13(2,3)11(9)6-7-12(15)16/h4,6-7,10-11,14H,5,8H2,1-3H3,(H,15,16)/b7-6+/t10-,11-/m1/s1 |
| InChIKey |
RCHGPOIUUPPMBL-AFPRHGJPSA-N |
| Molecular Weight |
224.300 g/mol |
| SMILES |
OC[C@@]1(C([C@](\C=C\C(=O)O)(C(=CC1)C)[H])(C)C)[H] |
| SPLASH |
splash10-0006-9300000000-c998686aaccc868d2e5e |
| Source of Spectrum |
J-52-2097-8 |
| Synonyms |
(2E)-3-[(1R,5S)-5-(hydroxymethyl)-2,6,6-trimethyl-2-cyclohexen-1-yl]-2-propenoic acid
cis (1',5')-(2E)-3-[2',6',6'-trimethyl-5'-(hydroxymethyl)-2'-cyclohexen-1'-yl]-2-propenoic acid |
| Wiley ID |
1225315 |
![2-Propenoic acid, 3-[5-(hydroxymethyl)-2,6,6-trimethyl-2-cyclohexen-1-yl]-, [1.alpha.(E),5.alpha.]-(.+-.)-](/api/spectrum/CS2H9NzmWMA/structure.png?h=300&w=458 "2-Propenoic acid, 3-[5-(hydroxymethyl)-2,6,6-trimethyl-2-cyclohexen-1-yl]-, [1.alpha.(E),5.alpha.]-(.+-.)-")
