CID 579269

Cyclopentene, 1,2,3,3,4-pentamethyl-

Structural Information

Molecular Formula
C10H18
SMILES
CC1CC(=C(C1(C)C)C)C
InChI
InChI=1S/C10H18/c1-7-6-8(2)10(4,5)9(7)3/h8H,6H2,1-5H3
InChIKey
QAIUVUJHCMVPTO-UHFFFAOYSA-N
Compound name
1,2,3,3,4-pentamethylcyclopentene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

138.14085 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.148126 127.6
[M+Na]+ 161.130068 137.4
[M-H]- 137.133574 132.2
[M+NH4]+ 156.174673 154.3
[M+K]+ 177.104008 135.9
[M+H-H2O]+ 121.138110 124.4
[M+HCOO]- 183.139051 151.2
[M+CH3COO]- 197.154701 178.0
[M+Na-2H]- 159.115516 131.7
[M]+ 138.14030142 128.6
[M]- 138.14139858 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