CID 144384

70220-96-1

Structural Information

Molecular Formula
C12H18O
SMILES
CC1(C2CCCC1C3CC2C=C3)O
InChI
InChI=1S/C12H18O/c1-12(13)10-3-2-4-11(12)9-6-5-8(10)7-9/h5-6,8-11,13H,2-4,7H2,1H3
InChIKey
GCFBIUOSKKLHSD-UHFFFAOYSA-N
Compound name
10-methyltricyclo[4.3.1.12,5]undec-3-en-10-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

178.13577 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.143046 140.8
[M+Na]+ 201.124988 147.6
[M-H]- 177.128494 141.4
[M+NH4]+ 196.169593 167.4
[M+K]+ 217.098928 143.6
[M+H-H2O]+ 161.133030 136.6
[M+HCOO]- 223.133971 155.6
[M+CH3COO]- 237.149621 152.9
[M+Na-2H]- 199.110436 146.8
[M]+ 178.13522142 137.2
[M]- 178.13631858 137.2
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