SpectraBase Spectrum ID |
HqwUM8wY7Ah |
Name |
Cycloprop[a]indene-5-propanoic acid, 1,1a,1b,2,3,4,6,6a-octahydro-1b-methyl-6a-(1-methylethyl)-4-oxo-, [1aS-(1a.alpha.,1b.beta.,6a.alpha.)]- |
CAS Registry Number |
88166-36-3 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H24O3 |
InChI |
InChI=1S/C17H24O3/c1-10(2)17-8-12-11(4-5-15(19)20)13(18)6-7-16(12,3)14(17)9-17/h10,14H,4-9H2,1-3H3,(H,19,20)/t14-,16+,17-/m1/s1 |
InChIKey |
XSUYLSJYOPFZDO-HYVNUMGLSA-N |
Molecular Weight |
276.376 g/mol |
SMILES |
OC(CCC1=C2C[C@]3([C@]([C@]2(CCC1=O)C)([H])C3)C(C)C)=O |
SPLASH |
splash10-016r-0090000000-37aaa1b2aae9dab8979e |
Source of Spectrum |
H-66-1815-0 |
Synonyms |
3-[(1aS,1bR,6aS)-6a-isopropyl-1b-methyl-4-oxo-1,1a,1b,2,3,4,6,6a-octahydrocyclopropa[a]inden-5-yl]propanoic acid
4.alpha.-isopropyl-1.beta.-methyl-8-oxotricylo[4.4.0.0(2,4)]decen-6-ene-7-propionic acid |
Wiley ID |
1280311 |