CID 349147

43119-66-0

Structural Information

Molecular Formula
C10H16O
SMILES
CC1(C2CC1C(C=C2)(C)O)C
InChI
InChI=1S/C10H16O/c1-9(2)7-4-5-10(3,11)8(9)6-7/h4-5,7-8,11H,6H2,1-3H3
InChIKey
QBKKSIMANOEXOI-UHFFFAOYSA-N
Compound name
2,6,6-trimethylbicyclo[3.1.1]hept-3-en-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

152.12012 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.127396 146.6
[M+Na]+ 175.109338 154.3
[M-H]- 151.112844 145.8
[M+NH4]+ 170.153943 169.3
[M+K]+ 191.083278 154.3
[M+H-H2O]+ 135.117380 139.7
[M+HCOO]- 197.118321 159.9
[M+CH3COO]- 211.133971 183.7
[M+Na-2H]- 173.094786 157.1
[M]+ 152.11957142 158.6
[M]- 152.12066858 158.6
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