CID 14433050

124869-09-6

Structural Information

Molecular Formula
C15H22O3
SMILES
CC1(CCCC23C1CC=C4C2C(OC4)OC3)CO
InChI
InChI=1S/C15H22O3/c1-14(8-16)5-2-6-15-9-18-13-12(15)10(7-17-13)3-4-11(14)15/h3,11-13,16H,2,4-9H2,1H3
InChIKey
VNQZAZXRYYZGBO-UHFFFAOYSA-N
Compound name
(5-methyl-11,13-dioxatetracyclo[7.5.1.01,6.012,15]pentadec-8-en-5-yl)methanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

250.15689 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.16417 156.0
[M+Na]+ 273.14611 162.0
[M-H]- 249.14961 161.1
[M+NH4]+ 268.19071 180.1
[M+K]+ 289.12005 160.2
[M+H-H2O]+ 233.15415 151.7
[M+HCOO]- 295.15509 168.2
[M+CH3COO]- 309.17074 167.5
[M+Na-2H]- 271.13156 160.3
[M]+ 250.15634 154.1
[M]- 250.15744 154.1
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

No patent data available for this compound.