CID 6427888

Refchem:119371

Structural Information

Molecular Formula
C10H16
SMILES
C[C@]12C[C@H](C=C1)C(C2)(C)C
InChI
InChI=1S/C10H16/c1-9(2)7-10(3)5-4-8(9)6-10/h4-5,8H,6-7H2,1-3H3/t8-,10+/m0/s1
InChIKey
FUIDRYCKEXJNOK-WCBMZHEXSA-N
Compound name
(1R,4R)-1,5,5-trimethylbicyclo[2.2.1]hept-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

136.1252 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.132476 130.7
[M+Na]+ 159.114418 140.3
[M-H]- 135.117924 134.4
[M+NH4]+ 154.159023 161.9
[M+K]+ 175.088358 137.8
[M+H-H2O]+ 119.122460 127.8
[M+HCOO]- 181.123401 153.2
[M+CH3COO]- 195.139051 174.9
[M+Na-2H]- 157.099866 137.0
[M]+ 136.12465142 131.2
[M]- 136.12574858 131.2
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

No patent data available for this compound.