U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H16O
Molecular Weight 152.2334
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (1S,2S,5R)-7,7-DIMETHYLSPIRO(BICYCLO(3.1.1)HEPTANE-2,2'-OXIRANE)

SMILES

CC1(C)[C@H]2C[C@@H]1[C@]3(CO3)CC2

InChI

InChIKey=OUXAABAEPHHZPC-KHQFGBGNSA-N
InChI=1S/C10H16O/c1-9(2)7-3-4-10(6-11-10)8(9)5-7/h7-8H,3-6H2,1-2H3/t7-,8+,10-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
(1S,2S,5R)-7,7-DIMETHYLSPIRO(BICYCLO(3.1.1)HEPTANE-2,2'-OXIRANE)
Systematic Name English
(1S-(1ALPHA,2BETA,5ALPHA))-6,6-DIMETHYLSPIRO(BICYCLO(3.1.1)HEPTANE-2,2'-OXIRANE)
Preferred Name English
SPIRO(BICYCLO(3.1.1)HEPTANE-2,2'-OXIRANE), 6,6-DIMETHYL-, (1S,2S,5R)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID401170650
Created by admin on Wed Apr 02 11:19:28 GMT 2025 , Edited by admin on Wed Apr 02 11:19:28 GMT 2025
PRIMARY
PUBCHEM
87749
Created by admin on Wed Apr 02 11:19:28 GMT 2025 , Edited by admin on Wed Apr 02 11:19:28 GMT 2025
PRIMARY
FDA UNII
D9W45QME6N
Created by admin on Wed Apr 02 11:19:28 GMT 2025 , Edited by admin on Wed Apr 02 11:19:28 GMT 2025
PRIMARY
CAS
18680-30-3
Created by admin on Wed Apr 02 11:19:28 GMT 2025 , Edited by admin on Wed Apr 02 11:19:28 GMT 2025
PRIMARY