CID 44154050

Octahydro-2-(4-methoxybutyl)-4,7-methano-1h-inden-2-ol

Structural Information

Molecular Formula
C15H26O2
SMILES
COCCCCC1(CC2C3CCC(C3)C2C1)O
InChI
InChI=1S/C15H26O2/c1-17-7-3-2-6-15(16)9-13-11-4-5-12(8-11)14(13)10-15/h11-14,16H,2-10H2,1H3
InChIKey
PBMHFJBOPZVADA-UHFFFAOYSA-N
Compound name
4-(4-methoxybutyl)tricyclo[5.2.1.02,6]decan-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.19328 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.20056 163.4
[M+Na]+ 261.18250 169.2
[M-H]- 237.18600 165.2
[M+NH4]+ 256.22710 190.2
[M+K]+ 277.15644 165.3
[M+H-H2O]+ 221.19054 160.0
[M+HCOO]- 283.19148 180.5
[M+CH3COO]- 297.20713 191.4
[M+Na-2H]- 259.16795 163.1
[M]+ 238.19273 163.3
[M]- 238.19383 163.3
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.