CID 207393

Brn 1238397

Structural Information

Molecular Formula
C14H24O2
SMILES
C1CCC2(CC1)CC(C3(O2)CCCCC3)O
InChI
InChI=1S/C14H24O2/c15-12-11-13(7-3-1-4-8-13)16-14(12)9-5-2-6-10-14/h12,15H,1-11H2
InChIKey
MQFGIIJQMBOVJC-UHFFFAOYSA-N
Compound name
7-oxadispiro[5.1.58.26]pentadecan-14-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.17763 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.18491 155.9
[M+Na]+ 247.16685 158.6
[M-H]- 223.17035 161.1
[M+NH4]+ 242.21145 177.6
[M+K]+ 263.14079 156.5
[M+H-H2O]+ 207.17489 149.8
[M+HCOO]- 269.17583 168.7
[M+CH3COO]- 283.19148 166.0
[M+Na-2H]- 245.15230 158.9
[M]+ 224.17708 145.3
[M]- 224.17818 145.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.