CID 111274

2-cyclohexen-1-ol, 1-methyl-4-(1-methylethenyl)-, (1r,4r)-rel-

Structural Information

Molecular Formula
C10H16O
SMILES
CC(=C)[C@@H]1CC[C@@](C=C1)(C)O
InChI
InChI=1S/C10H16O/c1-8(2)9-4-6-10(3,11)7-5-9/h4,6,9,11H,1,5,7H2,2-3H3/t9-,10-/m0/s1
InChIKey
MKPMHJQMNACGDI-UWVGGRQHSA-N
Compound name
(1R,4R)-1-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

5
References

744
Patents

152.12012 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.127396 133.5
[M+Na]+ 175.109338 140.0
[M-H]- 151.112844 135.8
[M+NH4]+ 170.153943 156.2
[M+K]+ 191.083278 138.1
[M+H-H2O]+ 135.117380 129.5
[M+HCOO]- 197.118321 152.8
[M+CH3COO]- 211.133971 175.1
[M+Na-2H]- 173.094786 138.1
[M]+ 152.11957142 129.9
[M]- 152.12066858 129.9
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.