CID 6431933

(+)-trans-p-menth-2-ene

Structural Information

Molecular Formula
C10H18
SMILES
C[C@@H]1CC[C@H](C=C1)C(C)C
InChI
InChI=1S/C10H18/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8-10H,5,7H2,1-3H3/t9-,10-/m0/s1
InChIKey
WHNGPXQYYRWQAS-UWVGGRQHSA-N
Compound name
(3R,6S)-3-methyl-6-propan-2-ylcyclohexene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

43
Patents

138.14085 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.14813 131.5
[M+Na]+ 161.13007 137.1
[M-H]- 137.13357 134.7
[M+NH4]+ 156.17467 153.5
[M+K]+ 177.10401 136.1
[M+H-H2O]+ 121.13811 126.4
[M+HCOO]- 183.13905 151.8
[M+CH3COO]- 197.15470 177.2
[M+Na-2H]- 159.11552 135.4
[M]+ 138.14030 128.6
[M]- 138.14140 128.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe