CID 6552009

(+)-borneol

Structural Information

Molecular Formula
C10H18O
SMILES
C[C@@]12CC[C@@H](C1(C)C)C[C@@H]2O
InChI
InChI=1S/C10H18O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7-8,11H,4-6H2,1-3H3/t7-,8+,10+/m1/s1
InChIKey
DTGKSKDOIYIVQL-WEDXCCLWSA-N
Compound name
(1R,2S,4R)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol
Related CIDs

2D Structure

compound 2d structure
9
Annotation Hits

729
References

69675
Patents

154.13577 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.14305 134.4
[M+Na]+ 177.12499 143.1
[M+NH4]+ 172.16959 147.0
[M+K]+ 193.09893 137.2
[M-H]- 153.12849 134.7
[M+Na-2H]- 175.11044 138.4
[M]+ 154.13522 135.9
[M]- 154.13632 135.9
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