CID 604434

Pkqmqrfloshpti-uhfffaoysa-n

Structural Information

Molecular Formula
C15H22
SMILES
CC1(C=CCC23C14C2CC(C4)C3(C)C)C
InChI
InChI=1S/C15H22/c1-12(2)6-5-7-14-11-8-10(13(14,3)4)9-15(11,12)14/h5-6,10-11H,7-9H2,1-4H3
InChIKey
PKQMQRFLOSHPTI-UHFFFAOYSA-N
Compound name
2,2,7,7-tetramethyltetracyclo[6.2.1.01,6.06,10]undec-3-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.17215 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.179426 143.2
[M+Na]+ 225.161368 154.4
[M-H]- 201.164874 148.5
[M+NH4]+ 220.205973 173.8
[M+K]+ 241.135308 149.7
[M+H-H2O]+ 185.169410 140.2
[M+HCOO]- 247.170351 157.3
[M+CH3COO]- 261.186001 156.6
[M+Na-2H]- 223.146816 149.6
[M]+ 202.17160142 150.9
[M]- 202.17269858 150.9
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.