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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H26O2
Molecular Weight 250.3764
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3,7,11-Trimethyldodeca-1,6,10-trien-3-yl formate, (S)-

SMILES

CC(C)=CCC\C(C)=C\CC[C@](C)(OC=O)C=C

InChI

InChIKey=GJPVEZJRYIBIOD-RBFDBLARSA-N
InChI=1S/C16H26O2/c1-6-16(5,18-13-17)12-8-11-15(4)10-7-9-14(2)3/h6,9,11,13H,1,7-8,10,12H2,2-5H3/b15-11+/t16-/m1/s1

HIDE SMILES / InChI

Molecular Formula C16H26O2
Molecular Weight 250.3764
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:52:35 GMT 2025
Edited
by admin
on Mon Mar 31 19:52:35 GMT 2025
Record UNII
T2KJC5FJQ3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, 3-formate, (3S)-
Preferred Name English
3,7,11-Trimethyldodeca-1,6,10-trien-3-yl formate, (S)-
Systematic Name English
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, formate, (3S)-
Systematic Name English
Nerolidyl formate
Systematic Name English
1,6,10-Dodecatrien-3-ol, 3,7,11-trimethyl-, formate, (S)-
Systematic Name English
(S)-3,7,11-Trimethyldodeca-1,6,10-trien-3-yl formate
Systematic Name English
Nerolidol formate
Systematic Name English
Code System Code Type Description
FDA UNII
T2KJC5FJQ3
Created by admin on Mon Mar 31 19:52:35 GMT 2025 , Edited by admin on Mon Mar 31 19:52:35 GMT 2025
PRIMARY
PUBCHEM
6436889
Created by admin on Mon Mar 31 19:52:35 GMT 2025 , Edited by admin on Mon Mar 31 19:52:35 GMT 2025
PRIMARY
ECHA (EC/EINECS)
214-196-2
Created by admin on Mon Mar 31 19:52:35 GMT 2025 , Edited by admin on Mon Mar 31 19:52:35 GMT 2025
PRIMARY
CAS
1112-99-8
Created by admin on Mon Mar 31 19:52:35 GMT 2025 , Edited by admin on Mon Mar 31 19:52:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID201186253
Created by admin on Mon Mar 31 19:52:35 GMT 2025 , Edited by admin on Mon Mar 31 19:52:35 GMT 2025
PRIMARY