CID 149224433

Gamma-pinene

Structural Information

Molecular Formula
C10H16
SMILES
CC1C=C[C@H]2C[C@@H]1C2(C)C
InChI
InChI=1S/C10H16/c1-7-4-5-8-6-9(7)10(8,2)3/h4-5,7-9H,6H2,1-3H3/t7?,8-,9-/m0/s1
InChIKey
XJBOZKOSICCONT-NPPUSCPJSA-N
Compound name
(1R,5S)-4,6,6-trimethylbicyclo[3.1.1]hept-2-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

136.1252 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.13248 139.6
[M+Na]+ 159.11442 146.8
[M-H]- 135.11792 139.9
[M+NH4]+ 154.15902 161.8
[M+K]+ 175.08836 147.4
[M+H-H2O]+ 119.12246 132.1
[M+HCOO]- 181.12340 154.5
[M+CH3COO]- 195.13905 184.5
[M+Na-2H]- 157.09987 149.9
[M]+ 136.12465 151.6
[M]- 136.12575 151.6
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.