CID 5366546

Methoprene

Structural Information

Molecular Formula
C19H34O3
SMILES
CC(C)OC(=O)/C=C(\C)/C=C/CC(C)CCCC(C)(C)OC
InChI
InChI=1S/C19H34O3/c1-15(2)22-18(20)14-17(4)11-8-10-16(3)12-9-13-19(5,6)21-7/h8,11,14-16H,9-10,12-13H2,1-7H3/b11-8+,17-14+
InChIKey
NFGXHKASABOEEW-LDRANXPESA-N
Compound name
propan-2-yl (2E,4E)-11-methoxy-3,7,11-trimethyldodeca-2,4-dienoate
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

684
References

104477
Patents

310.2508 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.25808 181.0
[M+Na]+ 333.24002 187.1
[M+NH4]+ 328.28462 185.1
[M+K]+ 349.21396 183.0
[M-H]- 309.24352 177.3
[M+Na-2H]- 331.22547 179.7
[M]+ 310.25025 180.4
[M]- 310.25135 180.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe