CID 527249

Dtxsid601250272

Structural Information

Molecular Formula
C10H18O
SMILES
CC(CCC1C(O1)(C)C)C=C
InChI
InChI=1S/C10H18O/c1-5-8(2)6-7-9-10(3,4)11-9/h5,8-9H,1,6-7H2,2-4H3
InChIKey
IQTYEDULQISSGT-UHFFFAOYSA-N
Compound name
2,2-dimethyl-3-(3-methylpent-4-enyl)oxirane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

187
Patents

154.13577 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.14305 134.8
[M+Na]+ 177.12499 144.0
[M-H]- 153.12849 140.4
[M+NH4]+ 172.16959 152.2
[M+K]+ 193.09893 144.0
[M+H-H2O]+ 137.13303 130.1
[M+HCOO]- 199.13397 155.8
[M+CH3COO]- 213.14962 183.6
[M+Na-2H]- 175.11044 140.9
[M]+ 154.13522 140.2
[M]- 154.13632 140.2
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.