CID 44148674

84304-13-2

Structural Information

Molecular Formula
C11H20O
SMILES
CC1CCC2C(C1CO)C2(C)C
InChI
InChI=1S/C11H20O/c1-7-4-5-9-10(8(7)6-12)11(9,2)3/h7-10,12H,4-6H2,1-3H3
InChIKey
HRQKYZLPDOKAFK-UHFFFAOYSA-N
Compound name
(3,7,7-trimethyl-2-bicyclo[4.1.0]heptanyl)methanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

168.15141 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.158686 138.6
[M+Na]+ 191.140628 148.2
[M-H]- 167.144134 142.9
[M+NH4]+ 186.185233 157.4
[M+K]+ 207.114568 145.5
[M+H-H2O]+ 151.148670 134.5
[M+HCOO]- 213.149611 156.4
[M+CH3COO]- 227.165261 184.2
[M+Na-2H]- 189.126076 143.5
[M]+ 168.15086142 140.0
[M]- 168.15195858 140.0
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.