CID 361990

Nsc625469

Structural Information

Molecular Formula
C10H16O
SMILES
C1C=CC2CC1CC(C2)CO
InChI
InChI=1S/C10H16O/c11-7-10-5-8-2-1-3-9(4-8)6-10/h1-2,8-11H,3-7H2
InChIKey
CKHDILYRGJQNMT-UHFFFAOYSA-N
Compound name
3-bicyclo[3.3.1]non-6-enylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.12012 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.12740 132.4
[M+Na]+ 175.10934 137.5
[M-H]- 151.11284 133.2
[M+NH4]+ 170.15394 154.5
[M+K]+ 191.08328 135.0
[M+H-H2O]+ 135.11738 127.5
[M+HCOO]- 197.11832 149.2
[M+CH3COO]- 211.13397 174.9
[M+Na-2H]- 173.09479 139.2
[M]+ 152.11957 127.6
[M]- 152.12067 127.6
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.