CID 7054244

[(1r,3s)-1,2,2,3-tetramethylcyclopentyl]methanol

Structural Information

Molecular Formula
C10H20O
SMILES
C[C@H]1CC[C@@](C1(C)C)(C)CO
InChI
InChI=1S/C10H20O/c1-8-5-6-10(4,7-11)9(8,2)3/h8,11H,5-7H2,1-4H3/t8-,10-/m0/s1
InChIKey
VEWDCYUJDMVTFQ-WPRPVWTQSA-N
Compound name
[(1R,3S)-1,2,2,3-tetramethylcyclopentyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

156.15141 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.158686 133.6
[M+Na]+ 179.140628 141.8
[M-H]- 155.144134 136.3
[M+NH4]+ 174.185233 160.3
[M+K]+ 195.114568 140.2
[M+H-H2O]+ 139.148670 131.1
[M+HCOO]- 201.149611 154.4
[M+CH3COO]- 215.165261 176.2
[M+Na-2H]- 177.126076 138.0
[M]+ 156.15086142 132.7
[M]- 156.15195858 132.7
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

patents stripe