CID 13833982

90176-52-6

Structural Information

Molecular Formula
C16H30O2
SMILES
CCCC/C=C\CCCCCCCCC(=O)OC
InChI
InChI=1S/C16H30O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18-2/h6-7H,3-5,8-15H2,1-2H3/b7-6-
InChIKey
JEDIPLFNJDRCFD-SREVYHEPSA-N
Compound name
methyl (Z)-pentadec-10-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

254.22458 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.23186 167.3
[M+Na]+ 277.21380 175.8
[M+NH4]+ 272.25840 173.3
[M+K]+ 293.18774 168.1
[M-H]- 253.21730 165.9
[M+Na-2H]- 275.19925 168.4
[M]+ 254.22403 167.8
[M]- 254.22513 167.8
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