CID 53427080

Sxnzujxnswypas-uhfffaoysa-n

Structural Information

Molecular Formula
C14H24O
SMILES
CC1(C2CCC(C2)C1C=CCCCO)C
InChI
InChI=1S/C14H24O/c1-14(2)12-8-7-11(10-12)13(14)6-4-3-5-9-15/h4,6,11-13,15H,3,5,7-10H2,1-2H3
InChIKey
SXNZUJXNSWYPAS-UHFFFAOYSA-N
Compound name
5-(3,3-dimethyl-2-bicyclo[2.2.1]heptanyl)pent-4-en-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.18271 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.189986 154.5
[M+Na]+ 231.171928 161.1
[M-H]- 207.175434 155.6
[M+NH4]+ 226.216533 180.3
[M+K]+ 247.145868 156.9
[M+H-H2O]+ 191.179970 151.0
[M+HCOO]- 253.180911 173.0
[M+CH3COO]- 267.196561 186.3
[M+Na-2H]- 229.157376 155.6
[M]+ 208.18216142 153.8
[M]- 208.18325858 153.8
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.